Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T14912 | Target Info | |||
| Target Name | Induced myeloid leukemia cell differentiation protein Mcl-1 (MCL1) | ||||
| Synonyms |
mcl1/EAT; Bcl2-L-3; Bcl-2-related protein EAT/mcl1; Bcl-2-like protein 3; BCL2L3
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| Target Type | Clinical trial Target | ||||
| Gene Name | MCL1 | ||||
| Biochemical Class | B-cell lymphoma Bcl-2 | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 91 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
ABT-737
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|
Terminated | Compound Info | ||
| Synonyms |
ABT-737; 852808-04-9; ABT 737; ABT737; UNII-Z5NFR173NV; Z5NFR173NV; 4-[4-[(4'-Chloro[1,1'-biphenyl]-2-yl)methyl]-1-piperazinyl]-N-[[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl]benzamide; CHEMBL376408; C42H45ClN6O5S2; 4-{4-[(4'-Chlorobiphenyl-2-Yl)methyl]piperazin-1-Yl}-N-{[4-({(1r)-3-(Dimethylamino)-1-[(Phenylthio)methyl]propyl}amino)-3-Nitrophenyl]sulfonyl}benzamide
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| Activity |
Ki ~ 100000 nM
|
[1] | |||
| Compound Name |
ACENAPHTHOQUINONE
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Investigative | Compound Info | ||
| Synonyms |
Acenaphthenequinone; 82-86-0; Acenaphthoquinone; acenaphthylene-1,2-dione; 1,2-ACENAPHTHYLENEDIONE; Acenaphthenedione; 1,2-Acenaphthenequinone; 1,2-Acenaphthenedione; Acenaphthaquinone; Acenaphthylene-1,2-quinone; Acenaphthylenequinone; acenaphthodione; 1,2-Diketoacenaphthene; acenaphthene-1,2-dione; diketoacenaphthene; acenaphthylenedione; UNII-3950D6UEIQ; acenaphthene quinone; CCRIS 5318; CHEBI:15342; HSDB 2660; NSC 7656; EINECS 201-441-3; 1,2-dihydroacenaphthylene-1,2-dione; BRN 0879172; 3950D6UEIQ; AFPRJLBZLPBTPZ-UHFFFAOYSA-N
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| Activity |
Ki = 57000 nM
|
[2] | |||
| Compound Name |
(E)-3-(1,3-Benzodioxol-5-yl)-1-(2-hydroxy-3,4,5-trimethoxyphenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814335; BDBM50176870
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(2,3-Dihydro-1-benzofuran-5-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814050; BDBM50176872
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-3-(3-Chloro-5-fluoro-4-hydroxyphenyl)-1-pyridin-4-ylprop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814948; BDBM50176883
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(2-Hydroxy-3,4,5-trimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3815059; BDBM50176879
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(6-Hydroxy-2,3,4-trimethoxyphenyl)-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814890; BDBM50176882
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
Nvp-cgm097
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Investigative | Compound Info | ||
| Synonyms |
CGM097; CGM-097; CGM 097; NVP-CGM-097; NVP CGM097; UNII-4UF6MSL0ZH; 4UF6MSL0ZH; C38H47ClN4O4; SCHEMBL2391192; SCHEMBL2391196; CHEMBL3601398; SCHEMBL18458199; KS-00000TSY; BDBM162123; BCP18308; EX-A1059; MFCD28144684; s7875; NVP-CGM097 (CGM-097); AKOS030526402; ZINC253387855; CCG-270337; CS-3138; NCGC00390552-01; AC-32967; AS-75288; HY-15954; W5747; J3.509.326E; A16326; US9051279, 106; Q27454942
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| Activity |
IC50 ~ 50000 nM
|
[4] | |||
| Compound Name |
(E)-1-(2,3-Dihydro-1-benzofuran-5-yl)-3-(3-fluoro-4-hydroxyphenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814171; BDBM50176865
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
5,6,7-Trimethoxy-2-(2-nitrophenyl)chromen-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3815010; BDBM50176867
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-3-(2-Hydroxy-4-methoxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814168; BDBM50176874
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(2-Hydroxy-3,4,5-trimethoxyphenyl)-3-(4-nitrophenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3813727; BDBM50176877
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(2S)-2-[(2S,3R)-10-[(4-Fluorophenyl)sulfonylamino]-3-methyl-2-[[methyl(naphthalen-1-ylcarbamoyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3358897; BDBM50041685
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
(E)-3-(3,5-Difluoro-4-hydroxyphenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814822; BDBM50176864
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
4'-Amino-5,6,7-trimethoxyflavone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950541; SCHEMBL737068; BDBM50176869; 2-(4-aminophenyl)-5,6,7-trimethoxychromen-4-one; 2-(4-Aminophenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
2-(2-Aminophenyl)-5,6,7-trimethoxychromen-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3813834; BDBM50176866
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(6-Hydroxy-2,3,4-trimethoxyphenyl)-3-(2-nitrophenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814699; BDBM50176880
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| Activity |
Ki ~ 50000 nM
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[3] | |||
| Compound Name |
(E)-1-(4-Hydroxyphenyl)-3-(pyridin-4-yl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814780; SCHEMBL1603994; ZINC9379491; BDBM50176875; STK788117; AKOS001296498; MCULE-6892655123; ST4146875; 1-(4-Hydroxyphenyl)-3-(pyridin-4-yl)prop-2-en-1-one; F3385-4445; (2E)-1-(4-hydroxyphenyl)-3-(4-pyridyl)prop-2-en-1-one; (2e)-1-(4-hydroxyphenyl)-3-pyridine-4-ylprop-2-en-1-one; (E)-1-(4-hydroxyphenyl)-3-(4-pyridyl)-2-propen-1-one; (2E)-1-(4-hydroxyphenyl)-3-(pyridin-4-yl)prop-2-en-1-one
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(2S)-2-[(4S)-4-[[4-(4-Chlorophenyl)phenyl]methyl]-2,5-dioxoimidazolidin-1-yl]-N-(3-nitrophenyl)sulfonyl-3-phenylpropanamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3629657; BDBM50130040
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| Activity |
Ki ~ 50000 nM
|
[6] | |||
| Compound Name |
5,6,7-Trimethoxy-2-[4-(trifluoromethyl)phenyl]chromen-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814762; BDBM50176868
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(2E)-3-(4-Hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
3-(4-hydroxyphenyl)-1-(4-methoxyphenyl)-2-propen-1-one; 3-(4-hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one; (E)-3-(4-hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one; 4-Hydroxy-4'-methoxychalcone; CHEMBL337821; NSC139722; 2-Propen-1-one,3-(4-hydroxyphenyl)-1-(4-methoxyphenyl)-; 4'-methoxy-4-hydroxychalcone; MLS001048854; SCHEMBL3889361; JS-118C; HMS2271E12; ZINC4046859; 8330AE; BDBM50176876; MFCD00210515; SBB101410; STK895224; AKOS002180896; NSC-139722; SMR000387060; ST50071164; VU0254870-3; AB00637146-07; SR-01000014453; J-501920; SR-01000014453-1; F1707-0101; (E)-1-(4-Methoxyphenyl)-3-(4-hydroxyphenyl)-2-propene-1-one
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(2-Hydroxy-3,4,5-trimethoxyphenyl)-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814538; BDBM50176878
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| Activity |
Ki ~ 50000 nM
|
[3] | |||
| Compound Name |
(E)-1-(6-Hydroxy-2,3,4-trimethoxyphenyl)-3-(4-nitrophenyl)prop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3814853; SCHEMBL736521; BDBM50176881
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| Activity |
Ki ~ 50000 nM
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[3] | |||
| Compound Name |
4'-Hydroxy-4-methoxychalcone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL268559; (E)-1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one; 4-methoxy-4'-hydroxychalcone; 1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one; NSC40922; NSC 40922; MLS001049039; SCHEMBL145787; 2-Propen-1-one, 1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-; HMS2268K10; ZINC4042308; BDBM50346810; MFCD00020170; NSC-40922; STL553603; AKOS002719662; 4,4'-Dihydroxychalcone, 4-Methyl ether; NCGC00246220-01; SMR000387051; AB00637078-07; SR-01000254504; SR-01000254504-1; 1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-ene-1-one; (E)-1-(4-Hydroxyphenyl)-3-(4-methoxyphenyl)-2-propene-1-one; (e)-1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-ene-1-one; 1-(4-Hydroxy-phenyl)-3-(4-methoxy-phenyl)-prop-2-en-1-one; (2E)-1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
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| Activity |
Ki ~ 50000 nM
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[3] | |||
| Compound Name |
(2S)-2-[(2S,3R)-3-Methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]carbamoyl]amino]methyl]-6-oxo-10-(2-phenylethylsulfonylamino)-3,4-dihydro-2H-1,5-benzoxazocin-5-yl]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3358903; BDBM50041678
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| Activity |
IC50 ~ 50000 nM
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[5] | |||
| Compound Name |
(2S)-2-[(2S,3R)-10-(Benzylsulfonylamino)-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]carbamoyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3358902; BDBM50041675
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| Activity |
IC50 ~ 50000 nM
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[5] | |||
| Compound Name |
(2S)-2-[(2S,3R)-10-[(4-Fluorophenyl)sulfonylamino]-3-methyl-2-[[methyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3358894; BDBM50041681
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
(2S)-2-[(4S)-4-[[4-(3-Methylphenyl)phenyl]methyl]-2,5-dioxoimidazolidin-1-yl]-N-(4-methylphenyl)sulfonyl-3-phenylpropanamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3629659; BDBM50130041
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| Activity |
Ki ~ 50000 nM
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[6] | |||
| Compound Name |
(2S)-2-[(2S,3R)-10-[(4-Fluorophenyl)sulfonylamino]-3-methyl-2-[[methyl(phenylcarbamoyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3358895; BDBM50041682
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
(E)-1-(2-Hydroxy-4-methoxyphenyl)-3-pyridin-4-ylprop-2-en-1-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3815058; NSC54653; ZINC4707205; BDBM50176873; NSC-54653
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| Activity |
Ki ~ 50000 nM
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[3] | |||
| Compound Name |
(2S)-2-[(2S,3R)-10-[(4-Fluorophenyl)sulfonylamino]-2-[[(4-methoxyphenyl)carbamoyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3358896; BDBM50041684
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
4-[(2-Chlorophenyl)methylsulfamoyl]-1-hydroxynaphthalene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3781306; SCHEMBL18392240; BDBM50158089
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| Activity |
Ki = 50300 nM
|
[7] | |||
| Compound Name |
2,3-Dihydro[1,4]thiazino[2,3,4-hi]indole-5-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3426311; BDBM50086708; AKOS015936405
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| Activity |
Ki = 51000 nM
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[8] | |||
| Compound Name |
5-Chloro-3-methyl-1-benzofuran-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
5-CHLORO-3-METHYLBENZOFURAN-2-CARBOXYLIC ACID; 5-Chloro-3-methyl-benzofuran-2-carboxylic acid; CHEMBL2314505; 5-chloro-3-methylbenzo[b]furan-2-carboxylic acid; Oprea1_357018; Oprea1_736190; SCHEMBL4615856; CTK0I3534; DTXSID60357729; ZINC4206072; BDBM50424781; MFCD02051257; SBB076120; STK873690; AKOS000360099; MCULE-5792048733; AS-42341; AB0082593; ST45207946; 3-Methyl-5-chlorobenzofuran-2-carboxylic acid; EN300-13007; 2-Benzofurancarboxylicacid, 5-chloro-3-methyl-; L-4397; 2-Benzofurancarboxylic acid, 5-chloro-3-methyl-; J-517351; Z57789904; F1673-6877; 5-chloro-3-methyl-benzofuran-2-carboxylic acid, AldrichCPR
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| Activity |
Ki = 52000 nM
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[9] | |||
| Compound Name |
1-Hydroxy-4-[(4-propan-2-yloxyphenyl)sulfamoyl]naphthalene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3780580; SCHEMBL18392410; BDBM50158180
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| Activity |
Ki = 54000 nM
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[7] | |||
| Compound Name |
4-(Benzylsulfamoyl)-1-hydroxynaphthalene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3780355; SCHEMBL18392400; BDBM50158088
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| Activity |
Ki = 56300 nM
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[7] | |||
| Compound Name |
2-[1-Methoxy-4-[(3-phenylphenyl)sulfonylamino]naphthalen-2-yl]sulfanylacetic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260039; SCHEMBL14851522; BDBM50013834
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| Activity |
IC50 = 58430 nM
|
[10] | |||
| Compound Name |
3,6-Dichloro-1-benzothiophene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
3,6-dichlorobenzo[b]thiophene-2-carboxylic acid; 3,6-Dichloro-benzo[b]thiophene-2-carboxylic acid; CHEMBL1448105; Benzo[b]thiophene-2-carboxylicacid, 3,6-dichloro-; IFLab1_003595; MLS000777260; SCHEMBL6886010; UNII-D6H647726W; CTK1C2636; HMS1422D09; ZINC176157; ALBB-000952; BBL015713; BDBM50424782; MFCD00781745; SBB006951; STK396196; AKOS000113955; D6H647726W; MCULE-9040814889; IDI1_009702; BS-13937; SC-13116; SMR000413655; AB0167220; HY-114855; CS-0064484; ST45138818; EN300-00845; L-3988; AF-399/25051010; SR-01000412428; J-019658; SR-01000412428-1; Q27451050; Z56896343; F0818-0022
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| Activity |
Ki = 59000 nM
|
[9] | |||
| Compound Name |
2-[1-Hydroxy-4-[(2-phenylacetyl)amino]naphthalen-2-yl]sulfanylacetic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3265306; SCHEMBL14842730; BDBM50013875
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| Activity |
Ki = 59350 nM
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[10] | |||
| Compound Name |
3-(4-Chloro-3,5-dimethylphenoxy)propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314512; BDBM50424718; ZINC11800214; AKOS000299971
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| Activity |
Ki = 60000 nM
|
[9] | |||
| Compound Name |
3-(3-Quinolin-6-yloxypropyl)-1H-indole-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314203; SCHEMBL15622781; BDBM50424755
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| Activity |
Ki = 62000 nM
|
[9] | |||
| Compound Name |
5-(4-Methylphenyl)sulfanyl-2-oxo-1H-pyridine-3-carbonitrile
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314375; BDBM50425956
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| Activity |
IC50 = 63100 nM
|
[2] | |||
| Compound Name |
2-[4-(Benzenesulfonamidomethyl)-1-hydroxynaphthalen-2-yl]sulfanylacetic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3265304; BDBM50013873
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| Activity |
Ki = 64750 nM
|
[10] | |||
| Compound Name |
3-[1-Hydroxy-4-(naphthalen-1-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260034; SCHEMBL14851339; BDBM50013884
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| Activity |
IC50 = 64900 nM
|
[10] | |||
| Compound Name |
delta(Sup 1),alpha-Acenaphthenemalononitrile, 2-oxo-
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Investigative | Compound Info | ||
| Synonyms |
UNII-E1D0M0NA1C; E1D0M0NA1C; CHEMBL2314369; NSC 92322; BRN 2973830; 2-Oxo-delta(sup1),alpha-acenaphthenemalononitrile; NSC92322; 2-Oxo-delta(sup 1),alpha-acenaphthenemalononitrile; Propanedinitrile, (2-oxo-1(2H)-acenaphthylenylidene)-; NCIOpen2_005967; .delta.(sup1), 2-oxo-; 2-(2-oxoacenaphthylen-1-ylidene)propanedinitrile; SCHEMBL2367407; 1-Dicyanmethylen-2-acenaphthenon; DTXSID90163294; ZINC497930; BDBM50425963; NSC-92322; 1-dicyanomethylene-2-oxo-acenaphthene; 1-(Dicyanomethylene)acenaphthen-2-one; 2-(Dicyanomethylene)acenaphthene-1-one; DS-012296; 2-Oxo-.delta.(sup1),.alpha.-acenaphthenemalononitrile; Propanedinitrile,2-(2-oxo-1(2h)-acenaphthylenylidene)-; Propanedinitrile, (2-oxo-1(2H)-acenaphthylenylidene)- (9CI)
Click to Show/Hide
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||||
| Activity |
IC50 = 71500 nM
|
[2] | |||
| Compound Name |
2-Hydroxy-5-(4-methylphenyl)benzoic Acid
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Investigative | Compound Info | ||
| Synonyms |
4-hydroxy-4'-methyl[1,1'-biphenyl]-3-carboxylic acid; 4-Hydroxy-4'-methyl-[1,1'-biphenyl]-3-carboxylic acid; CHEMBL3126312; 4-hydroxy-4'-methylbiphenyl-3-carboxylic acid; 4-Hydroxy-4'-methyl-biphenyl-3-carboxylic acid; [1,1'-Biphenyl]-3-carboxylicacid, 4-hydroxy-4'-methyl-; SCHEMBL4967083; CTK1D5438; DTXSID90404896; KS-000022HD; ZINC2565437; BDBM50449348; MFCD00434467; AKOS004119236; AS-2780; DB-070389; BB 0222382; FT-0705391
Click to Show/Hide
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||||
| Activity |
IC50 = 73000 nM
|
[11] | |||
| Compound Name |
2-[1-Hydroxy-4-(methanesulfonamido)naphthalen-2-yl]sulfanylacetic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3265289; SCHEMBL14851493; BDBM50013840
Click to Show/Hide
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||||
| Activity |
Ki = 74920 nM
|
[10] | |||
| Compound Name |
5-Bromo-1-methyl-1H-indole-2-carboxylic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
5-Bromo-1-methylindole-2-carboxylic acid; CHEMBL2314510; 1H-Indole-2-carboxylic acid, 5-bromo-1-methyl-; SCHEMBL418126; CTK5I8154; ALBB-005040; KS-00002X2F; ZINC9482840; 2806AF; BDBM50424777; MFCD07364562; STK262439; AKOS002332299; MCULE-2296665716; RS-0328; 5-bromo-1-methyl-2-indolecarboxylic acid; DA-01243; BB 0241914; FT-0706525; ST50765257; 5-Bromo-1-methyl-1H-indole-2-carboxylic acid #; Q27464828
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||||
| Activity |
Ki = 81000 nM
|
[9] | |||
| Compound Name |
2-Oxo-5-phenylsulfanyl-1H-pyridine-3-carbonitrile
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314374; BDBM50425957
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||||
| Activity |
IC50 = 82200 nM
|
[2] | |||
| Compound Name |
3-(1-Naphthylmethylsulfanyl)-1H-1,2,4-triazole
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314513; 5-[(1-naphthylmethyl)sulfanyl]-1H-1,2,4-triazole; ZINC3176387; BDBM50424717; STK978340; AKOS000616471; AKOS001624374; MCULE-5838210029; AF-399/37297047; SR-01000429828; SR-01000429828-1; 5-((naphthalen-1-ylmethyl)thio)-1H-1,2,4-triazole; 1H-1,2,4-Triazole, 3-[(1-naphthalenylmethyl)thio]-; 3-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazole; F0910-1198
Click to Show/Hide
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||||
| Activity |
Ki = 86000 nM
|
[9] | |||
| Compound Name |
2-((4-(4-Bromophenylsulfonamido)-1-methoxynaphthalen-2-yl)thio)acetic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260035; SCHEMBL14842727; BDBM50013885; 2-[4-[(4-bromophenyl)sulfonylamino]-1-methoxynaphthalen-2-yl]sulfanylacetic acid
Click to Show/Hide
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||||
| Activity |
Ki = 86980 nM
|
[10] | |||
| Compound Name |
3-Methyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraene-2-carboxylic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3426314; BDBM50086711
Click to Show/Hide
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||||
| Activity |
Ki = 90000 nM
|
[8] | |||
| Compound Name |
4-Bromo-6-chloro-1-benzofuran-2-carboxylic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314509; BDBM50424779
Click to Show/Hide
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||||
| Activity |
Ki = 90000 nM
|
[9] | |||
| Compound Name |
4-Aminosulphonyl-1-hydroxy-2-naphthoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
1-hydroxy-4-sulfamoylnaphthalene-2-carboxylic acid; NSC122281; CHEMBL1410420; NSC-122281; 2-Naphthalenecarboxylic acid, 4-(aminosulfonyl)-1-hydroxy-; 4-Aminosulfonyl-1-hydroxy-2-naphthoic acid; 4-Aminosulfonyl-1-hydroxy-2-naphthoic-acid; NCIStruc1_001970; 1-hydroxy-4-sulfamoyl-2-naphthoic acid; EINECS 264-882-0; 4-AMINOSULFONYL-1-HYDROXY-2-NAPHTHOICACID,97; NCIStruc2_000773; SCHEMBL589651; CTK2F4858; DTXSID10214671; ZINC394847; BDBM50158086; CCG-37513; NCGC00014248; NCI122281; AKOS024319198; MCULE-2603268565; NCGC00014248-02; NCGC00097357-01; NCI60_000521; ST50410008; 4-(aminosulfonyl)-1-hydroxy-2-naphthoic acid; 4-Aminosulfonyl-1-hydroxy-2-naphthalenecarboxylic acid; 1-Hydroxy-4-(hydroxysulfonimidoyl)-2-naphthoic acid #; 2-Naphthalenecarboxylicacid, 4-(aminosulfonyl)-1-hydroxy-
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||||
| Activity |
Ki = 99000 nM
|
[7] | |||
| Compound Name |
4-[[(2R)-4-(Dimethylamino)-1-phenylsulfanylbutan-2-yl]amino]-3-nitro-N-(4-piperazin-1-ylphenyl)benzenesulfonamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2063891; BDBM50388979
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||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
4-[4-[[2-(4-Chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-(propan-2-ylamino)-3-(trifluoromethylsulfonyl)phenyl]sulfonylbenzamide
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3126115; BDBM50448456
Click to Show/Hide
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||||
| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
Chembl4218364
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
BDBM50453277
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||||
| Activity |
Ki ~ 100000 nM
|
[14] | |||
| Compound Name |
N-(4-Hydroxynaphthalen-1-yl)benzenesulfonamide
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Investigative | Compound Info | ||
| Synonyms |
N-(4-hydroxy-1-naphthyl)benzenesulfonamide; PCMD-CC-MCM-216; PC-0599220; SCHEMBL589708; cid_694880; CHEMBL3265307; BDBM43305; CTK1B5998; ZINC68466; DTXSID90351255; HMS1579F07; STK793114; AKOS001766221; MCULE-6664944004; (4-hydroxynaphthyl)(phenylsulfonyl)amine; ST097935; EU-0051835; N-(4-hydroxy-1-naphthalenyl)benzenesulfonamide; N-(4-oxidanylnaphthalen-1-yl)benzenesulfonamide; AB00075941-01; AQ-390/13304001; SR-01000519768; Benzenesulfonamide, N-(4-hydroxy-1-naphthalenyl)-; SR-01000519768-1; BRD-K02681342-001-01-5; F0433-0037
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||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
Chembl4225591
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Investigative | Compound Info | ||
| Synonyms |
BDBM50461772
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||||
| Activity |
Ki ~ 100000 nM
|
[15] | |||
| Compound Name |
Chembl4202491
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
BDBM50453276
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||||
| Activity |
Ki ~ 100000 nM
|
[14] | |||
| Compound Name |
5-(4-Chlorophenyl)-1,2-dimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]-4-phenylpyrrole-3-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2159733; BDBM50393835
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||||
| Activity |
IC50 ~ 100000 nM
|
[16] | |||
| Compound Name |
Chembl4203274
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Investigative | Compound Info | ||
| Synonyms |
BDBM50453273
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||||
| Activity |
Ki ~ 100000 nM
|
[14] | |||
| Compound Name |
5-(4-Chlorophenyl)-4-[3-[4-[4-[[4-[[(2R)-4-(dimethylamino)-1-phenylsulfanylbutan-2-yl]amino]-3-nitrophenyl]sulfonylcarbamoyl]phenyl]piperazin-1-yl]phenyl]-1,2-dimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]pyrrole-3-carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2159734; BDBM50393834
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||||
| Activity |
IC50 ~ 100000 nM
|
[16] | |||
| Compound Name |
4-(4-((4'-Chloro-4,4-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl)piperazin-1-yl)benzoic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3126114; C26H31ClN2O2; SCHEMBL1567421; CTK8C0532; KS-00000QCX; DTXSID90648576; EX-A3755; ANW-64847; BDBM50448457; MFCD16251302; ZINC65739331; AKOS016005295; DS-2506; MP-2003; SB18166; AK103381; AB0068681; DB-059146; FT-0664870; Z3836
Click to Show/Hide
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||||
| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
2-[1-Methoxy-4-[(4-phenylphenyl)sulfonylamino]naphthalen-2-yl]sulfanylacetic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260038; SCHEMBL14851510; BDBM50013888
Click to Show/Hide
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||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
Chembl4203453
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
BDBM50453283
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||||
| Activity |
Ki ~ 100000 nM
|
[14] | |||
| Compound Name |
Chembl4227950
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
BDBM50461766
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||||
| Activity |
Ki = 100000 nM
|
[15] | |||
| Compound Name |
(R)-4-(4-(Dimethylamino)-1-(phenylthio)butan-2-ylamino)-3-nitrobenzenesulfonamide
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2063881; SCHEMBL376632; BDBM50388981; ZINC65740484
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
4-[[(2R)-4-(Dimethylamino)-1-phenylsulfanylbutan-2-yl]amino]-3-nitro-N-phenylbenzenesulfonamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2063890; SCHEMBL12685615; BDBM50388978
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||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
4-(4-Chlorophenyl)-1-[(3s)-3,4-Dihydroxybutyl]-N-[3-(4-Methylpiperazin-1-Yl)propyl]-3-Phenyl-1h-Pyrrole-2-Carboxamide
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2063880; BDBM50388980; Q27458226; B50
Click to Show/Hide
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||||
| Activity |
IC50 ~ 100000 nM
|
[16] | |||
| Compound Name |
2-((4-(4-Bromophenylsulfonamido)-1-methoxynaphthalen-2-yl)thio)acetamide
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260037; SCHEMBL14844761; BDBM50013887; 2-[4-[(4-bromophenyl)sulfonylamino]-1-methoxynaphthalen-2-yl]sulfanylacetamide
Click to Show/Hide
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||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
Methyl 2-((4-(4-bromophenylsulfonamido)-1-methoxynaphthalen-2-yl)thio)acetate
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260036; SCHEMBL14842490; BDBM50013886; methyl 2-[4-[(4-bromophenyl)sulfonylamino]-1-methoxynaphthalen-2-yl]sulfanylacetate
Click to Show/Hide
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||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
4-Bromo-N-(3-butylsulfanyl-4-hydroxynaphthalen-1-yl)benzenesulfonamide
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3265308; SCHEMBL14842279; BDBM50013877
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
4-Bromo-N-[3-(4-hydroxybutyl)-4-methoxynaphthalen-1-yl]benzenesulfonamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3260040; SCHEMBL15953049; BDBM50013835
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
Chembl4208097
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
BDBM50453280
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||||
| Activity |
Ki ~ 100000 nM
|
[14] | |||
| Compound Name |
2-[5-[(4-Bromophenyl)sulfonylamino]-2-hydroxyphenyl]sulfanylacetic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3265302; SCHEMBL14842533; BDBM50013870
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[10] | |||
| Compound Name |
3,7-Dimethyl-benzofuran-2-carboxylic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
3,7-dimethyl-1-benzofuran-2-carboxylic acid; 3,7-dimethylbenzofuran-2-carboxylic acid; CHEMBL2314507; SCHEMBL11748492; CTK7J1247; DTXSID40390336; ZINC4502750; 5405AD; BDBM50424722; AKOS000360032; MCULE-7987044630; NE30358; NCGC00327699-01; ST086603; 3,7-dimethylbenzo[b]furan-2-carboxylic acid; EN300-53340; AB01323190-02; 3,7-dimethyl-1-benzofuran-2-carboxylic acid, AldrichCPR; F2169-0501; Z803145518
Click to Show/Hide
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||||
| Activity |
Ki = 102000 nM
|
[9] | |||
| Compound Name |
(4-Chloro-3-methylphenoxy)acetic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
2-(4-chloro-3-methylphenoxy)acetic acid; (4-Chloro-3-methyl-phenoxy)-acetic acid; Acetic acid, (4-chloro-3-methylphenoxy)-; 4-chloro-3-methylphenoxyacetic acid; CHEMBL177299; BRN 1963793; Acetic acid, ((4-chloro-m-tolyl)oxy)-; NSC30119; 4-06-00-02065 (Beilstein Handbook Reference); ARONIS004021; SCHEMBL7493102; CTK5A8926; KS-00003WVV; ZINC38647; DTXSID10207523; 3-methyl-4-chlorophenoxyacetic acid; ALBB-000819; 6151AE; BBL014307; BDBM50424719; MFCD01671841; NSC-30119; SBB009311; STK003435; AKOS000114558; MCULE-5714027283; (4-Chloro-3-methyl-phenoxy)acetic acid; ST054900; VS-04261; AB0153761; BB 0244018; FT-0677822; EN300-00114; W-8530; AN-329/40159148; SR-01000430139; J-501384; SR-01000430139-1; (4-chloro-3-methyl-phenoxy)-acetic acid, AldrichCPR; Z56823032; F0722-7382
Click to Show/Hide
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||||
| Activity |
Ki = 103000 nM
|
[9] | |||
| Compound Name |
1-Hydroxy-4-(phenylsulfamoyl)naphthalene-2-carboxylic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3780724; SCHEMBL18392310; BDBM50158165
Click to Show/Hide
|
||||
| Activity |
Ki = 106000 nM
|
[7] | |||
| Compound Name |
2-Hydroxynicotinonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
3-Cyano-2-hydroxypyridine; 2-Hydroxy-3-cyanopyridine; 2-Hydroxypyridine-3-carbonitrile; 1,2-DIHYDRO-2-OXOPYRIDINE-3-CARBONITRILE; 2-oxo-1,2-dihydropyridine-3-carbonitrile; 2-oxo-1H-pyridine-3-carbonitrile; cyanopyridone; 3-Pyridinecarbonitrile, 1,2-dihydro-2-oxo-; 3-CYANO-2(1H)-PYRIDINONE; 3-CYANO-2-PYRIDONE; CHEMBL2314370; MFCD00661865; MFCD07363805; cyano-pyridone; Ethylchrysanthemumate; PubChem6539; PubChem20421; oxo-3-pyridinecarbonitrile; 2-Hydroxynicotinonitrile #; ACMC-209fc3; 3-Cyano-2(1H)-pyridone; KSC494I9D; SCHEMBL490790; CTK3J4491; DTXSID20942771; 1,2-dihydro-2-oxonicotinonitrile; ACT04540; ALBB-020186; KS-000003DZ; 3-Cyano-2-oxo-1,2-dihydropyridine; ANW-24145; ANW-51440; BBL102924; BDBM50425962; CL0099; SBB065243; STL556733; WT1308; ZB1365; ZINC12471465; AKOS000164099; AKOS004910826; AC-9404; AS-8431; CS-W002655; LS20339; MCULE-3971639231; NE59866; PB21004; PS-4156; SB10364; VP13627; 2-HYDROXY-3-PYRIDINECARBONITRILE; 3-Cyano-2(1H)-pyridinone, AldrichCPR; AC-23035; AK-28516; BR-28516; SY003014; 2-oxo-1,2-dihydro-3-pyridinecarbonitrile; 1,2-Dihydro-2-oxo-pyridine-3-carbonitrile; 2-Oxo-1,2-dihydro-pyridine-3-carbonitrile; 20577-27-9 2-Hydroxy-3-cyanopyridine; 3-PYRIDINECARBONITRILE, 2-HYDROXY-; AB0023303; DB-080364; AM20050933; FT-0650437; FT-0651807; FT-0691713; W4330; EN300-36887; S-2068; 577D279; 577H279; AQ-917/41144544; J-509683; W-201794; F8889-4542; Z969559768
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||||
| Activity |
Ki = 109000 nM
|
[2] | |||
| Compound Name |
5-(4-Bromophenyl)sulfanyl-2-oxo-1H-pyridine-3-carbonitrile
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314378; BDBM50425953
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|
||||
| Activity |
IC50 = 121100 nM
|
[2] | |||
| Compound Name |
Naphtho[1,2-d][1,3]oxazol-2-ol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3126336; 1H-benzo[e][1,3]benzoxazol-2-one; benzo[e]benzoxazol-2-ol; naphtho[1,2-d]oxazolone; Oprea1_860548; SCHEMBL5407779; ZINC4015378; BBL008961; BDBM50449366; MFCD00464297; STK366626; AKOS005443142; CCG-320798; MCULE-3738812642; ST50905663
Click to Show/Hide
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||||
| Activity |
IC50 = 130000 nM
|
[11] | |||
| Compound Name |
5,6-Dihydro-4H-pyrrolo[3,2,1-ij]quinoline-2-carboxylic acid
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3426312; SCHEMBL3064664; CTK8G6394; BDBM50086709; 5,6-dihydro-3h-pyrrolo[3,2,1-ij]quinoline-2-carboxylic acid; 1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-2-carboxylic acid
Click to Show/Hide
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||||
| Activity |
Ki = 131000 nM
|
[8] | |||
| Compound Name |
3-Chlorobenzo[b]thiophene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
3-Chloro-1-benzothiophene-2-carboxylic acid; 3-Chloro-benzo[b]thiophene-2-carboxylic acid; Benzo[b]thiophene-2-carboxylic acid, 3-chloro-; 3-chlorobenzothiophene-2-carboxylic acid; 3-Chloro-benzo[b]thiophene-2-carboxylicacid; 3-Chlorobenzo(b)thiophene-2-carboxylic acid; MFCD00014579; SR-03000000694-1; 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLICACID; NSC206632; PubChem18541; 3-chloro-benzo[b]thiophene carboxylic acid; ACMC-1COC0; CBMicro_009255; EC-000.1743; Cambridge id 5131128; SCHEMBL444722; ARONIS000439; cid_307964; CHEMBL1318391; BDBM67473; CTK1A2939; ZINC66959; DTXSID10308665; ALBB-000118; KS-00000WQ9; KS-00003U4V; SMSF0003588; ANW-24372; BBL014286; GEO-00659; SBB006950; STK061928; AKOS000267327; CCG-125311; FS-1392; MCULE-2104684798; NSC-206632; VT20215; SC-78306; ST095667; BIM-0008966.P001; AB0071708; DB-030919; 3-Chlorobenzo[b]-2-thiophenecarboxylic acid; BB 0218104; FT-0615461; Z2721; 3-chloro-2-benzo[b]thiophene carboxylic acid; 3-chlorobenzo [b]thiophene-2-carboxylic acid; 3-chloranyl-1-benzothiophene-2-carboxylic acid; 3-Chloro-1-benzothiophene-2-carboxylic acid #; 3-chloro-benzo[b]thio-phene-2-carboxylic acid; Benzo[b]thiophene-2-carboxylicacid, 3-chloro-; W-6212; AH-357/03390039; 3-Chloro-benzo[b]thiophene-2-carboxylic acid, 97%; W-200215; Z56899077
Click to Show/Hide
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||||
| Activity |
Ki = 131000 nM
|
[9] | |||
| Compound Name |
5-(4-Aminophenyl)sulfanyl-2-oxo-1H-pyridine-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314379; BDBM50425952
Click to Show/Hide
|
||||
| Activity |
IC50 = 133300 nM
|
[2] | |||
| Compound Name |
7-Methyl-3-phenyl-1H-indole-2-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314511; SCHEMBL3611265; BDBM50424720; STK319198; ZINC12650903; AKOS002291834; CCG-279122; MCULE-2613330604; 7-methyl-3-phenylindole-2-carboxylic acid; ST50781354
Click to Show/Hide
|
||||
| Activity |
Ki = 136000 nM
|
[9] | |||
| Compound Name |
5-Naphthalen-1-yl-2-oxo-1H-pyridine-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314371; BDBM50425960
Click to Show/Hide
|
||||
| Activity |
IC50 = 158500 nM
|
[2] | |||
| Compound Name |
2-Hydroxy-5-(methylsulfanyl)benzoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
Benzoic acid, 2-hydroxy-5-(methylthio)-; 2-hydroxy-5-methylsulfanylbenzoic acid; 5-(methylthio)salicylic acid; CHEMBL3126334; 5-(METHYLTHIO)-SALICYLIC ACID; Benzoic acid,2-hydroxy-5-(methylthio)-; Salicylic acid, 5-(methylthio)-; 2-hydroxy-5-(methylthio)benzoic acid; SCHEMBL3187695; CTK4G8507; DTXSID60344492; ZINC4787230; 5-methylthio-2-hydroxy-benzoic acid; BDBM50449368; 5-(METHYLTHIO)SALICYLIC ACID); AKOS022641649; MCULE-8366731578; DA-06904; 2-Hydroxy-5-(methylsulfanyl)benzoic acid #; FT-0759001; Q27454059; Z2583036246
Click to Show/Hide
|
||||
| Activity |
IC50 = 160000 nM
|
[11] | |||
| Compound Name |
1-Methylindole-2-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
1-Methyl-1H-indole-2-carboxylic acid; 1H-INDOLE-2-CARBOXYLIC ACID, 1-METHYL-; 1-Methyl-2-indolecarboxylic acid; Indole-2-carboxylic acid, 1-methyl-; CHEMBL36834; MFCD00005801; BRN 0007274; NSC68357; N-Methylindolcarbonsaure; PubChem20609; ACMC-1BPRU; ChemDiv3_011259; 5-22-03-00015 (Beilstein Handbook Reference); SCHEMBL117186; MAHAMBLNIDMREX-UHFFFAOYSA-; DTXSID60167123; HMS1504P17; ZINC142380; (N-methyl)indole-2-carboxylic acid; 1-methyl-1H-indole carboxylic acid; ALBB-007751; d-asparticacid(obzl)-obzlp-tosylate; KS-00000G6K; 1-methyl-1H-2-indolecarboxylic acid; ANW-21929; BBL037008; BDBM50424778; NSC-68357; SBB049025; STK120292; 1-methyl-1H-indol-2-carboxylic acid; AKOS000262610; CG-0519; CS-W007740; MCULE-7606431397; VI30129; IDI1_028817; 1-Methylindole-2-carboxylic acid, 98%; AC-22708; AK-29896; BR-29896; ST039851; SY050484; AB0014458; DB-027144; AM20060408; BB 0220035; EU-0015870; FT-0637326; M1519; EN300-51846; M-4050; S-1864; 136M586; A810257; CS-007/03901012; F0919-4682
Click to Show/Hide
|
||||
| Activity |
Ki = 160000 nM
|
[9] | |||
| Compound Name |
5-[4-(2-Methylbutan-2-yl)phenyl]sulfanyl-2-oxo-1H-pyridine-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314377; BDBM50425954
Click to Show/Hide
|
||||
| Activity |
IC50 = 177500 nM
|
[2] | |||
| Compound Name |
3'-Amino-4-hydroxybiphenyl-3-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL193114; BDBM50449349
Click to Show/Hide
|
||||
| Activity |
IC50 = 190000 nM
|
[11] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 13 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
5-(4-Chlorophenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
5-(4-chlorophenyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile; 5-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonitrile; CHEMBL2314372; MFCD00231524; 5-(4-chlorophenyl)-2-hydroxy-nicotinonitrile; 5-(4-Chlorophenyl)-1,2-dihydro-2-oxo-3-pyridinecarbonitrile; Oprea1_100700; SCHEMBL8305565; CTK4H5704; KS-00000EKM; DTXSID10377199; ZINC169102; 1586AE; BDBM50425959; SBB097661; AKOS005070419; 4J-342S; MCULE-4242738019; 3cyano-5-(4-chlorophenyl)-2-pyridinone; SY045417; 3-cyano-5-(4-chlorophenyl)-2-pyridinone; DB-107112; FT-0680363; 3-cyano-5-(4-chlorophenyl)-2-(1H)-pyridone; 5-(4-Chloro-phenyl)-2-hydroxy-nicotinonitrile; J-516228; 5-(4-chlorophenyl)-2-oxohydropyridine-3-carbonitrile; 5-(4-CHLOROPHENYL)-3-CYANO-2-(1H)-PYRIDONE; 1,2-Dihydro-5-(4-chlorophenyl)-2-oxopyridine-3-carbonitrile
Click to Show/Hide
|
||||
| Activity |
IC50 = 205400 nM
|
[2] | |||
| Compound Name |
3,6,7-Trimethyl-benzofuran-2-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
3,6,7-trimethyl-1-benzofuran-2-carboxylic acid; CHEMBL2314508; 3,6,7-trimethylbenzo[b]furan-2-carboxylic acid; CTK7J1246; DTXSID00424464; ZINC4502658; 1401AF; BDBM50424721; SBB027848; STK522124; AKOS000301965; MCULE-2119528168; NCGC00322626-01; ST090114; 3,6,7-Trimethylbenzofuran-2-carboxylic acid; AB01266325-03; BRD-K77466920-001-01-1; Z57904574; F2169-0516
Click to Show/Hide
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||||
| Activity |
Ki = 214000 nM
|
[9] | |||
| Compound Name |
2-Hydroxy-5-phenylnicotinonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
2-Hydroxy-5-phenyl-nicotinonitrile; 2-oxo-5-phenyl-1H-pyridine-3-carbonitrile; CHEMBL1539493; 2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile; 2-Oxo-5-phenyl-1,2-dihydropyridine-3-carbonitrile; 5-phenyl-2-hydroxynicotinonitrile; NSC167775; Bionet2_000885; Oprea1_877688; MLS000328019; SCHEMBL5397726; 3-cyano-5-phenylpyridin-2-one; KS-00001WIQ; DTXSID00304858; HMS1366I05; HMS2356D03; ZINC8670324; BDBM50425961; MFCD07801332; AKOS002303418; AKOS006240237; 4J-408S; MCULE-1752130450; NSC-167775; DA-30322; SMR000168552; 2-hydroxy-5-phenylpyridine-3-carbonitrile; FT-0752251; ST50328524; AB00529653-02; F3284-7439
Click to Show/Hide
|
||||
| Activity |
IC50 = 261000 nM
|
[2] | |||
| Compound Name |
2-Naphthalenol, 8-(dimethylamino)-
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
8-(dimethylamino)naphthalen-2-ol; CHEMBL3126337; CTK8D5608; 1-(N-Dimethyl)amino-7-naphthol; DTXSID80970691; BDBM50449365
Click to Show/Hide
|
||||
| Activity |
IC50 = 280000 nM
|
[11] | |||
| Compound Name |
2-Oxo-5-(4-phenylphenyl)-1H-pyridine-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314373; BDBM50425958
Click to Show/Hide
|
||||
| Activity |
IC50 = 316200 nM
|
[2] | |||
| Compound Name |
1-Benzyl-2-oxo-5-(4-propan-2-ylphenyl)sulfanylpyridine-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314380; BDBM50425951
Click to Show/Hide
|
||||
| Activity |
IC50 = 383100 nM
|
[2] | |||
| Compound Name |
1-(3-Naphthalen-1-yloxypropyl)indole-2-carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2314185; BDBM50424739
Click to Show/Hide
|
||||
| Activity |
Ki > 500000 nM
|
[9] | |||
| Compound Name |
Methyl 4-[(4-bromophenyl)-(2-methylpropyl)sulfamoyl]-1-methoxynaphthalene-2-carboxylate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3781985; SCHEMBL18392304; BDBM50158358
Click to Show/Hide
|
||||
| Activity |
Ki > 500000 nM
|
[7] | |||
| Compound Name |
Methyl 4-[(4-bromophenyl)-(2-methylpropyl)sulfamoyl]-1-hydroxynaphthalene-2-carboxylate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3780242; SCHEMBL18392243; BDBM50158357
Click to Show/Hide
|
||||
| Activity |
Ki > 500000 nM
|
[7] | |||
| Compound Name |
N-[4-(Phenoxymethyl)phenyl]sulfonyl-2-phenylbenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1824802; BDBM50352168
Click to Show/Hide
|
||||
| Activity |
IC50 > 1000000 nM
|
[17] | |||
| Compound Name |
Indole-2-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
1H-Indole-2-carboxylic acid; 2-Carboxyindole; 2-Indolecarboxylic acid; Indol-2-Carboxylic Acid; MFCD00005611; 1H-Indolecarboxylic acid; NSC 16598; Indole-2-carboxylate; 2-INDOLYLFORMIC ACID; CHEMBL278390; N-[4-(2-Pyridinyl)-2-thiazolyl]-2-pyridinamine; Indole-2-carboxylic acid, 99%; EINECS 216-030-4; carboxyindole; 2-Indolecarboxylate; indolecarboxylic acid; indole carboxylic acid; PubChem1690; 2-carboxy-1H-indole; 2-indolcarboxylic acid; Spectrum_001485; 2-indol carboxylic acid; SpecPlus_000676; 1H-Indole-2-carboxylic; Spectrum2_000021; Spectrum3_000943; Spectrum4_001042; Spectrum5_001735; ACMC-1BU3Q; 1H-2-indolecarboxylic acid; 1H-indole-2-carboxylicacid; SCHEMBL1935; 2-Indolecarboxylicacid(Indole-2-carboxylicacid); 1H-indol-2-carboxylic acid; Oprea1_557882; KBioGR_001304; KBioSS_001965; KSC170A9B; MLS002207203; DivK1c_006772; SPECTRUM1502082; SPBio_000081; 1H-indole-2-carbonsure; 2-INDOLE CARBOXYLIC ACID; HCUARRIEZVDMPT-UHFFFAOYSA-; Indole-2-carboxylic acid, 98%; KBio1_001716; KBio2_001965; KBio2_004533; KBio2_007101; KBio3_002006; DTXSID20163782; HMS1921H22; ZINC145536; ACN-S002762; ACT06982; BCP00082; CS-M1850; HY-I0096; NSC16598; STR02479; ANW-21089; BBL004548; BDBM50004955; CCG-39889; HTS006381; NSC-16598; s6228; SBB003953; STK001808; 1H-Indole-2-carboxylic acid (9CI); AKOS000121595; AB00454; AC-3062; CG-0515; MCULE-2072698467; SDCCGMLS-0065971.P001; KS-000005V7; NCGC00094957-01; NCGC00094957-02; AK-46085; BR-46085; SC-01199; SMR000112260; SY003715; AB0008354; DB-011564; BB 0242376; FT-0627213; FT-0627228; FT-0651889; I0332; ST45028103; 77I505; B-7291; I-2300; AQ-776/40177767; SR-01000392684; SR-01000392684-1; Q27461367; F0451-0610
Click to Show/Hide
|
||||
| Activity |
Ki > 1000000 nM
|
[8] | |||
| Compound Name |
Benzofuran-2-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
Coumarilic acid; 1-Benzofuran-2-carboxylic acid; Benzo[b]furan-2-carboxylic acid; 2-BENZOFURANCARBOXYLIC ACID; 2-Carboxybenzofuran; Coumarone-2-carboxylic acid; MFCD00005848; UNII-7Z6NMG947L; Benzo(b)furan-2-carboxylic acid; 2-Benzofuran carboxylic acid; CHEMBL84095; 7Z6NMG947L; NSC6165; Benzo[b]furan-2-carboxylic acid, 98%; NSC 6165; EINECS 207-818-9; benzofuran-2-carboxylicacid; BRN 0124204; AI3-03711; PubChem7019; Maybridge1_002455; ACMC-209kh6; 2-benzofuranecarboxylic acid; Cambridge id 5102130; benzofuran 2-carboxylic acid; 5-18-06-00419 (Beilstein Handbook Reference); KSC173I5H; DivK1c_001207; SCHEMBL155789; 1-benzofurane-2-carboxylic acid; DTXSID2060090; HMS548H13; ZINC53963; 1-Benzofuran-2-carboxylic acid #; 2,3-benzofuran-2-carboxylic acid; 4,5-benzofuran-2-carboxylic acid; ACN-S004172; ALBB-016356; KS-00000MZ3; NSC-6165; Benzofuran-2-carboxylic acid, 99%; ANW-30808; BBL018112; BDBM50345230; SBB000137; STK293001; AKOS000103488; AB00533; CS-W004676; MCULE-5646971945; SDCCGMLS-0065938.P001; SS-6002; CDS1_000167; NCGC00324555-01; AK-29301; BR-29301; SC-04821; ST021134; SY005603; DB-022566; AM20050579; BB 0244005; FT-0622682; A19599; L-1275; AB01319519-02; 496B413; AN-278/25047013; J-640024; J-800026; Q-101915; Q27269061; Z56839706; F3096-1740
Click to Show/Hide
|
||||
| Activity |
Ki > 1000000 nM
|
[9] | |||
| Compound Name |
4-Phenoxy-N-(4-phenylphenyl)sulfonylbenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1824810; BDBM50352176
Click to Show/Hide
|
||||
| Activity |
IC50 > 1000000 nM
|
[17] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Design, synthesis, and activity evaluation of broad-spectrum small-molecule inhibitors of anti-apoptotic Bcl-2 family proteins: characteristics of broad-spectrum protein binding and its effects on anti-tumor activity. Bioorg Med Chem Lett. 2012 Jan 1;22(1):39-44. | ||||
| REF 2 | Fragment-based design, synthesis, and biological evaluation of N-substituted-5-(4-isopropylthiophenol)-2-hydroxynicotinamide derivatives as novel Mcl-1 inhibitors. Eur J Med Chem. 2013 Feb;60:410-20. | ||||
| REF 3 | DARC: Mapping Surface Topography by Ray-Casting for Effective Virtual Screening at Protein Interaction Sites. J Med Chem. 2016 May 12;59(9):4152-70. | ||||
| REF 4 | Discovery of a Dihydroisoquinolinone Derivative (NVP-CGM097): A Highly Potent and Selective MDM2 Inhibitor Undergoing Phase 1 Clinical Trials in p53wt Tumors. J Med Chem. 2015 Aug 27;58(16):6348-58. | ||||
| REF 5 | Single Diastereomer of a Macrolactam Core Binds Specifically to Myeloid Cell Leukemia 1 (MCL1). ACS Med Chem Lett. 2014 Nov 11;5(12):1308-12. | ||||
| REF 6 | Design, synthesis and preliminary bioactivity studies of imidazolidine-2,4-dione derivatives as Bcl-2 inhibitors. Bioorg Med Chem. 2015 Dec 1;23(23):7359-65. | ||||
| REF 7 | Structure-based design of N-substituted 1-hydroxy-4-sulfamoyl-2-naphthoates as selective inhibitors of the Mcl-1 oncoprotein. Eur J Med Chem. 2016 May 4;113:273-92. | ||||
| REF 8 | Discovery of tricyclic indoles that potently inhibit Mcl-1 using fragment-based methods and structure-based design. J Med Chem. 2015 May 14;58(9):3794-805. | ||||
| REF 9 | Discovery of potent myeloid cell leukemia 1 (Mcl-1) inhibitors using fragment-based methods and structure-based design. J Med Chem. 2013 Jan 10;56(1):15-30. | ||||
| REF 10 | 3-Substituted-N-(4-hydroxynaphthalen-1-yl)arylsulfonamides as a novel class of selective Mcl-1 inhibitors: structure-based design, synthesis, SAR, and biological evaluation. J Med Chem. 2014 May 22;57(10):4111-33. | ||||
| REF 11 | Fragment-based discovery of potent inhibitors of the anti-apoptotic MCL-1 protein. Bioorg Med Chem Lett. 2014 Mar 15;24(6):1484-8. | ||||
| REF 12 | Design of Bcl-2 and Bcl-xL inhibitors with subnanomolar binding affinities based upon a new scaffold. J Med Chem. 2012 May 24;55(10):4664-82. | ||||
| REF 13 | Discovery of potent Mcl-1/Bcl-xL dual inhibitors by using a hybridization strategy based on structural analysis of target proteins. J Med Chem. 2013 Dec 12;56(23):9635-45. | ||||
| REF 14 | Discovery of Mcl-1 inhibitors based on a thiazolidine-2,4-dione scaffold. Bioorg Med Chem Lett. 2018 Feb 1;28(3):523-528. | ||||
| REF 15 | Kronke pyridines: Rapid and facile access to Mcl-1 inhibitors. Bioorg Med Chem Lett. 2018 Jun 1;28(10):1949-1953. | ||||
| REF 16 | Structure-based design of potent Bcl-2/Bcl-xL inhibitors with strong in vivo antitumor activity. J Med Chem. 2012 Jul 12;55(13):6149-61. | ||||
| REF 17 | SAR by interligand nuclear overhauser effects (ILOEs) based discovery of acylsulfonamide compounds active against Bcl-x(L) and Mcl-1. J Med Chem. 2011 Sep 8;54(17):6000-13. | ||||
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