Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T73184 | Target Info | |||
| Target Name | Histone-lysine N-methyltransferase SETD7 (SETD7) | ||||
| Synonyms |
SET9; SET7/9; SET7; SET domain-containing protein 7; Lysine N-methyltransferase 7; KMT7; KIAA1717; Histone H3-K4 methyltransferase SETD7; H3-K4-HMTase SETD7
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| Target Type | Literature-reported Target | ||||
| Gene Name | SETD7 | ||||
| Biochemical Class | Methyltransferase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 22 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
GSK343
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Investigative | Compound Info | ||
| Synonyms |
compound 6 [PMID 24900432]; GSK 343
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| Activity |
IC50 = 63000 nM
|
[1] | |||
| Compound Name |
4-(10,11-Dihydro-5-dibenzo[a,d]cycloheptenylidene)-1-methylpiperidine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL152622; SCHEMBL7817056; CTK6I2219; BDBM50097222; AKOS005064175; 4-(10,11-dihydro-5h-dibenzo[a,d][7]annulen-5-ylidene)-1-methylpiperidine; 4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-1-methylpiperidine; 4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-methylpiperidine; 4-(10,11-Dihydro-dibenzo[a,d]cyclohepten-5-ylidene)-1-methyl-piperidine; 5-(1-Methylpiperidin-4-ylidene)-10,11-dihydro-5H-dibenzo[a,d]cycloheptene; 4-(5,6-dihydrodibenzo[1,2-a:1',2'-e][7]annulen-11-ylidene)-1-methylpiperidine
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| Activity |
IC50 = 59100 nM
|
[2] | |||
| Compound Name |
Ethyl 2-amino-5-[(3-cyanophenyl)carbamoyl]-4-methylthiophene-3-carboxylate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3623769; BDBM50124904
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| Activity |
IC50 = 61550 nM
|
[3] | |||
| Compound Name |
N-(3-Nitrophenyl)-1,3-benzodioxole-5-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1577117; N-{3-nitrophenyl}-1,3-benzodioxole-5-carboxamide; MLS000702488; HMS2536D24; ZINC2744940; BDBM50124899; STK416666; AKOS003278801; MCULE-5773106307; SMR000227262; AK-968/12386139; N-(3-nitrophenyl)benzo[d][1,3]dioxole-5-carboxamide; Q27209952; F2299-0295
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| Activity |
IC50 = 61750 nM
|
[3] | |||
| Compound Name |
N-[4-(4-Aminophenyl)sulfonylphenyl]-4-phenylbenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1797443; BDBM50346710
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| Activity |
IC50 = 66400 nM
|
[4] | |||
| Compound Name |
N-(3-Nitrophenyl)-5-methylfuran-3-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3623578; BDBM50124897
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| Activity |
IC50 = 89180 nM
|
[3] | |||
| Compound Name |
Piperidine, 4-(diphenylmethylene)-1-methyl-
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Investigative | Compound Info | ||
| Synonyms |
4-(Diphenylmethylene)-1-methylpiperidine; 4-benzhydrylidene-1-methylpiperidine; CHEMBL347536; NSC 31633; BRN 0208076; NSC31633; (N-Methyl piperidylene-4) diphenyl methane [French]; (N-Methyl piperidylene-4) diphenyl methane; 5-20-08-00324 (Beilstein Handbook Reference); SCHEMBL4079255; DTXSID40209535; BDBM50097226; NSC-31633; 4-Benzhydrylidene-1-methyl-piperidine; 4-Diphenylmethylene-1-methylpiperidine; 1-Methyl-4-(diphenylmethylene)piperidine; 4-(diphenylmethylidene)-1-methylpiperidine
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| Activity |
IC50 = 94600 nM
|
[2] | |||
| Compound Name |
N-(2-Methoxybenzyl)-1-(3-((2-(methylamino)ethylamino)methyl)phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1080460; SCHEMBL5069659; BDBM50311688
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| Activity |
IC50 ~ 100000 nM
|
[5] | |||
| Compound Name |
1-Methyl-4-(9h-xanthen-9-yl)piperazine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL20468; NSC25187; CTK4E0790; DTXSID30282251; BDBM50187211; NSC-25187; ZINC19365280; Piperazine,1-methyl-4-(9H-xanthen-9-yl)-
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
6,7-Dimethoxy-2-(pyrrolidin-1-yl)-N-(5-(pyrrolidin-1-yl)pentyl)quinazolin-4-amine
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Investigative | Compound Info | ||
| Synonyms |
UNC0379; UNC-0379; CHEMBL3318285; UNC 0379; 6,7-Dimethoxy-2-pyrrolidin-1-yl-N-(5-pyrrolidin-1-ylpentyl)quinazolin-4-amine; C23H35N5O2; CS-3345; HY-12335; SCHEMBL22568439; AOB6365; EX-A461; SYN5081; BCP10429; KS-00000T5A; 3362AH; BDBM50051117; MFCD28167817; s7570; ZINC98214604; AKOS025404942; UNC 0379;UNC-0379; CCG-268809; SB19349; NCGC00384189-06; NCGC00384189-10; AK174945; AS-16447; DA-43617; B8009; FT-0699830; A14320; UNC0379 trifluoroacetate salt, >=98% (HPLC)
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| Activity |
IC50 ~ 100000 nM
|
[6] | |||
| Compound Name |
1-Methyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyloxy)piperidine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3828123; BDBM50187209
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
Cyproheptadine M (nor), acetylated
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3809971; BDBM50173504
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| Activity |
IC50 ~ 100000 nM
|
[7] | |||
| Compound Name |
1-Methyl-4-(9H-thioxanthen-9-yl)piperazine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3827652; BDBM50187210
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|
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
(S)-1-(5-((2-Aminopropanamido)methyl)thiophen-3-yl)-N-(2-methoxybenzyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
pyrazole scaffold, 7a; CHEMBL475503; SCHEMBL5064201; BDBM27642; ZINC40406065
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
Methyl 2-[[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]benzoate
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Investigative | Compound Info | ||
| Synonyms |
PRMT5-IN-C17; ZINC00659298; ChemDiv1_002844; Oprea1_645106; CHEMBL4092336; HMS595B06; ZINC5455374; STK346078; AKOS000421473; AKOS000830714; MCULE-9755352312; AG-690/12869587; SR-01000429953; SR-01000429953-1; Z16078172; methyl 2-({[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl}amino)benzoate; methyl 2-({[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl}amino)benzoate; methyl 2-{2-[(6-methoxy-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamido}benzoate
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| Activity |
IC50 ~ 100000 nM
|
[9] | |||
| Compound Name |
1-Methyl-4-(9H-xanthen-9-yloxy)piperidine
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3827386; BDBM50187208
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|
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
1-(11H-Dibenzo[1,2-a:1',2'-e][7]annulen-11-yl)-4-methylpiperazine
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3828393; SCHEMBL10864039; BDBM50187212
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|
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
1-Methyl-4-(9H-thioxanthen-9-yloxy)piperidine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3827431; BDBM50187207
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-phenacylpiperidin-4-one
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802467; BDBM50347712
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|
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| Activity |
IC50 = 149000 nM
|
[10] | |||
| Compound Name |
1-((2-(1H-Indol-3-yl)ethyl)amino)-3-(9H-carbazol-9-yl)-propan-2-ol
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Investigative | Compound Info | ||
| Synonyms |
DC_05; DC-05; CHEMBL3358015; C25H25N3O; AOB6967; SYN5082; BDBM50031317; AKOS002242638; AKOS016316322; NCGC00402253-02; AS-16448; DC_05, >=98% (HPLC); HY-12746; ST50753266; 1-carbazol-9-yl-3-[(2-indol-3-ylethyl)amino]propan-2-ol; 1-carbazol-9-yl-3-[2-(1H-indol-3-yl)ethylamino]propan-2-ol; 1-(9H-Carbazole-9-yl)-3-[[2-(1H-indole-3-yl)ethyl]amino]-2-propanol
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| Activity |
IC50 ~ 150000 nM
|
[11] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-[(3-chlorophenyl)methyl]piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802461; BDBM50347705
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| Activity |
IC50 = 174000 nM
|
[10] | |||
| Compound Name |
4-Methyl-3-nitro-N-(3-nitrophenyl)benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3623579; Oprea1_608432; ZINC2081217; BDBM50124898; STK411597; AKOS001068295; MCULE-7615418402; ST50917357; 3-nitro-N-{3-nitrophenyl}-4-methylbenzamide; N-(3-Nitrophenyl)-3-nitro-4-methylbenzamide; AK-968/11635171; (4-methyl-3-nitrophenyl)-N-(3-nitrophenyl)carboxamide
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| Activity |
IC50 = 189700 nM
|
[3] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 9 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-1-isopropyl-6-(6-(4-methylpiperazin-1-yl)pyridin-3-yl)-1H-indazole-4-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
GSK926; CHEMBL2204998; SCHEMBL2590353; BDBM50400779
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| Activity |
IC50 = 214000 nM
|
[1] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-[(4-methylphenyl)methyl]piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802459; BDBM50347706
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| Activity |
IC50 > 333000 nM
|
[10] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-[(4-chlorophenyl)methyl]piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802462; BDBM50347708
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| Activity |
IC50 > 600000 nM
|
[10] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-(2-phenylethyl)piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802465; BDBM50347707
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| Activity |
IC50 > 667000 nM
|
[10] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-[(2-methylphenyl)methyl]piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802457; BDBM50347709
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| Activity |
IC50 > 667000 nM
|
[10] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-[(2-chlorophenyl)methyl]piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802460; BDBM50347711
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| Activity |
IC50 > 667000 nM
|
[10] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-(3-phenylpropyl)piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802466; BDBM50347710
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| Activity |
IC50 > 667000 nM
|
[10] | |||
| Compound Name |
Carm1-IN-1
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL261261; BDBM50347703; ZINC29051656; AKOS030260402; CS-3970; HY-12759; (3E,5E)-1-BENZYL-3,5-BIS(3-BROMO-4-HYDROXYBENZYLIDENE)PIPERIDIN-4-ONE; (3E,5E)-1-benzyl-3,5-bis[(3-bromo-4-hydroxyphenyl)methylidene]piperidin-4-one
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| Activity |
IC50 > 667000 nM
|
[10] | |||
| Compound Name |
(3E,5E)-3,5-Bis[(3-bromo-4-hydroxyphenyl)methylidene]-1-[(3-methylphenyl)methyl]piperidin-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1802458; BDBM50347704
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| Activity |
IC50 > 667000 nM
|
[10] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Identification of Potent, Selective, Cell-Active Inhibitors of the Histone Lysine Methyltransferase EZH2. ACS Med Chem Lett. 2012 Oct 19;3(12):1091-6. | ||||
| REF 2 | Steric structure-activity relationship of cyproheptadine derivatives as inhibitors of histone methyltransferase Set7/9. Bioorg Med Chem. 2016 Sep 15;24(18):4318-4323. | ||||
| REF 3 | Discovery and Optimization of Novel, Selective Histone Methyltransferase SET7 Inhibitors by Pharmacophore- and Docking-Based Virtual Screening. J Med Chem. 2015 Oct 22;58(20):8166-81. | ||||
| REF 4 | Acyl derivatives of p-aminosulfonamides and dapsone as new inhibitors of the arginine methyltransferase hPRMT1. Bioorg Med Chem. 2011 Jun 15;19(12):3717-31. | ||||
| REF 5 | 1,2-Diamines as inhibitors of co-activator associated arginine methyltransferase 1 (CARM1). Bioorg Med Chem Lett. 2009 Dec 1;19(23):6725-32 | ||||
| REF 6 | Discovery of a selective, substrate-competitive inhibitor of the lysine methyltransferase SETD8. J Med Chem. 2014 Aug 14;57(15):6822-33. | ||||
| REF 7 | Identification of Cyproheptadine as an Inhibitor of SET Domain Containing Lysine Methyltransferase 7/9 (Set7/9) That Regulates Estrogen-Dependent Transcription. J Med Chem. 2016 Apr 28;59(8):3650-60. | ||||
| REF 8 | N-Benzyl-1-heteroaryl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamides as inhibitors of co-activator associated arginine methyltransferase 1 (CARM1). Bioorg Med Chem Lett. 2009 Feb 15;19(4):1218-23. | ||||
| REF 9 | Potent, Selective, and Cell Active Protein Arginine Methyltransferase 5 (PRMT5) Inhibitor Developed by Structure-Based Virtual Screening and Hit Optimization. J Med Chem. 2017 Jul 27;60(14):6289-6304. | ||||
| REF 10 | Novel 3,5-bis(bromohydroxybenzylidene)piperidin-4-ones as coactivator-associated arginine methyltransferase 1 inhibitors: enzyme selectivity and cellular activity. J Med Chem. 2011 Jul 14;54(13):4928-32. | ||||
| REF 11 | Identifying novel selective non-nucleoside DNA methyltransferase 1 inhibitors through docking-based virtual screening. J Med Chem. 2014 Nov 13;57(21):9028-41. | ||||
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