Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T51426 | Target Info | |||
| Target Name | Farnesoid X-activated receptor (FXR) | ||||
| Synonyms |
Retinoid X receptor-interacting protein 14; RXR-interacting protein 14; RIP14; Nuclear receptor subfamily 1 group H member 4; HRR1; Farnesol receptor HRR-1; FXR; Bile acid receptor; BAR
Click to Show/Hide
|
||||
| Target Type | Successful Target | ||||
| Gene Name | NR1H4 | ||||
| Biochemical Class | Nuclear hormone receptor | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 65 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Ursodeoxycholic acid
Click to Show/Hide
|
Approved | Compound Info | ||
| Synonyms |
Actigall; Antigall; Arsacol; Delursan; Destolit; Deursil; Litursol; Lyeton; Peptarom; Solutrat; UDCA; UDCS; UrSO; Urosiol; Ursacol; Ursobilin; Ursochol; Ursodamor; Ursodeoxycholate; Ursodiol; Ursofalk; Ursolvan; Ursosan; Acide ursodesoxycholique; Acido ursodeossicolico; Acido ursodeossicolico [Italian]; Acido ursodeoxicolico; Acidum ursodeoxycholicum; Deoxyursocholic Acid; Sodium Ursodeoxycholate; Ursacholic Acid; Urso DS; Urso Forte; Ursodeoxy cholic acid; Ursodesoxycholicacid; Ursodexycholic Acid; Ursodiol [USAN]; IU5; U0030; Urso 250; Acide ursodesoxycholique [INN-French]; Acido ursodeoxicolico [INN-Spanish]; Acidum ursodeoxycholicum [INN-Latin]; Actigall (TN); Cholit-ursan; Deursil (TN); Dom-ursodiol c; ISO-URSODEOXYCHOLIC ACID; PHL-ursodiol c; PMS-ursodiol c; U-9000; Urso (TN); Urso Forte (TN); Ursodiol (USP); Ursosan (TN); Ursodeoxycholic acid (JP15/INN); Ursodeoxycholic acid, UDCA, Ursosan, Ursofalk, Urso Forte, Udiliv, Ursodiol; Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)-(9CI); (3alpha,5beta,7beta)-3,7-dihydroxycholan-24-oic acid; (3alpha,5beta,7beta,8xi)-3,7-dihydroxycholan-24-oic acid; (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; 17-beta-(1-Methyl-3-carboxypropyl)etiocholane-3-alpha,7-beta-diol; 3 alpha,7 beta-Dihydroxy-5 beta-cholan-24-oic Acid; 3,7-Dihydroxycholan-24-oic acid; 3-alpha,7-beta-Dihydroxy-5-beta-cholanoic acid; 3-alpha,7-beta-Dihydroxycholanic acid; 3-alpha,7-beta-Dioxycholanic acid; 3alpha,7beta-Dihydroxy-5beta-cholan-24-oic acid; 3alpha,7beta-Dihydroxy-5beta-cholanic acid; 5beta-Cholan-24-oic acid-3alpha,7beta-diol; 5beta-Cholanic Acid-3alpha,7beta-diol; 7-beta-Hydroxylithocholic acid; 7beta-Hydroxylithocholic acid
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
Cholic Acid
Click to Show/Hide
|
Approved | Compound Info | ||
| Synonyms |
cholic acid; 81-25-4; Cholalic acid; cholate; Cholalin; Colalin; Cholsaeure; NSC-6135; Cholic acid, 5beta-; 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanic acid; 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oic acid; UNII-G1JO7801AE; HSDB 982; (R)-4-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-Trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid; Cholic acid [USAN]; 3,7,12-Trihydroxycholanic acid; G1JO7801AE; CHEMBL205596; CHEBI:16359; NSC6135; BHQCQFFYRZLCQQ-OELDTZBJSA-N
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
ATX-101
Click to Show/Hide
|
Phase 3 | Compound Info | ||
| Synonyms |
ATX-101, APIM Therapeutics; Proliferating cell nuclear antigen (peptide, cancer), APIM
Click to Show/Hide
|
||||
| Activity |
EC50 = 50000 nM
|
[3] | |||
| Compound Name |
INT-777
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
TGR5 agonist (oral, metabolic disorder), Intercept
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
(4R)-4-[(5S,7S,8R,9S,10S,13R,14S,17R)-7-Ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL270494; BDBM50375554
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
Chembl4202981
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL16738556; BDBM50459099
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 50118.72 nM
|
[4] | |||
| Compound Name |
Chembl4205214
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL16738400; BDBM50459098
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 50118.72 nM
|
[4] | |||
| Compound Name |
Chembl4217797
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
BDBM50459096
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 50118.72 nM
|
[4] | |||
| Compound Name |
16-Epi-Avicholic Acid Sodium Salt
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062552
Click to Show/Hide
|
||||
| Activity |
EC50 = 55000 nM
|
[2] | |||
| Compound Name |
12-Epi-scalarin
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
12-Episcalarin; CHEMBL269105; BDBM50226462; Q27225761
Click to Show/Hide
|
||||
| Activity |
IC50 = 60400 nM
|
[5] | |||
| Compound Name |
(4R)-4-[(3R,6R,7R,8S,9S,10S,13R,14S)-3,7-Dihydroxy-6-(2-hydroxyethyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3138046
Click to Show/Hide
|
||||
| Activity |
EC50 = 61150 nM
|
[6] | |||
| Compound Name |
Chembl4160865
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
BDBM50286737
Click to Show/Hide
|
||||
| Activity |
IC50 = 64000 nM
|
[7] | |||
| Compound Name |
(1R,5Bs,11aS,13R,13aS,13bS)-5b-(hydroxymethyl)-8,8,11a,13a-tetramethyl-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[2,1-c]furan-1,13-diol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL219377; BDBM50192926
Click to Show/Hide
|
||||
| Activity |
IC50 = 64500 nM
|
[8] | |||
| Compound Name |
3-[(1S)-1-(1,6-Dimethylbenzimidazol-2-yl)-3-methylbutyl]-1-(4-phenoxyphenyl)imidazolidine-2,4-dione
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4102690; BDBM50231131
Click to Show/Hide
|
||||
| Activity |
IC50 = 65600 nM
|
[9] | |||
| Compound Name |
12-O-Deacetyl-12-epi-scalarin
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL399743; BDBM50226459
Click to Show/Hide
|
||||
| Activity |
IC50 = 75000 nM
|
[5] | |||
| Compound Name |
2-[(1S)-1-[3-[4-(4-Methoxyphenoxy)phenyl]-2,5-dioxoimidazolidin-1-yl]-3-methylbutyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4059655; BDBM50231001
Click to Show/Hide
|
||||
| Activity |
IC50 = 75300 nM
|
[9] | |||
| Compound Name |
Chembl4160181
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
BDBM50290176; 3alpha-[(beta-D-Glucopyranosyl)oxy]-12alpha-hydroxy-5beta-cholanic acid
Click to Show/Hide
|
||||
| Activity |
EC50 = 76000 nM
|
[10] | |||
| Compound Name |
2-[(1S)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-2,2-dimethylpropyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4101514; BDBM50230998
Click to Show/Hide
|
||||
| Activity |
IC50 = 77100 nM
|
[9] | |||
| Compound Name |
(1R,5Br,11aS,13R,13aS,13bS)-1-hydroxy-5b,8,8,11a,13a-pentamethyl-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[2,1-c]furan-13-yl acetate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL413656; BDBM50192924
Click to Show/Hide
|
||||
| Activity |
IC50 = 81100 nM
|
[8] | |||
| Compound Name |
2-[(1R)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-2-phenylethyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4093639; BDBM50230990
Click to Show/Hide
|
||||
| Activity |
IC50 = 87500 nM
|
[9] | |||
| Compound Name |
Guggulsterone
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
(Z)-Guggulsterone; Z-Guggulsterone; Guggulsterone E&Z; GUGGULSTERONE Z; Guggulsterones Z; Cis-Guggulsterone; UNII-6CST3U34GN; 6CST3U34GN; (Z)-Pregna-4,17(20)-diene-3,16-dione; (17Z)-Pregna-4,17(20)-diene-3,16-dione; Gugulsterone; Guggulsterone, (Z)-; Pregna-4,17(20)-diene-3,16-dione, (17Z)-; Guggulsterones E&Z; (E&Z)-Guggulsterone; DSSTox_CID_13539; DSSTox_RID_79083; DSSTox_GSID_33539; SCHEMBL141657; CHEMBL410683; DTXSID1033539; BDBM21725; BCP18087; Tox21_202518; MFCD01310757; AKOS015963432; ZINC118912814; (Z)-Guggulsterone, analytical standard; AC-6215; CCG-267610; NCGC00091910-01; NCGC00260067-01; AC-28813; (17Z)-pregna-4,17-diene-3,16-dione; 4,17(20)-trans-Pregnadiene-3,16-dione; HY-107738; CS-0029421; S3792; V2228; (Z)-Guggulsterone, >=89% (HPLC), powder; 2-(2-Aminothiazol-3(2H)-yl)-1-phenylethanone; 975G556; BRD-K26674531-001-01-3; Q27264514; UNII-A4PW148END component WDXRGPWQVHZTQJ-OSJVMJFVSA-N; Guggulsterone Z, United States Pharmacopeia (USP) Reference Standard
Click to Show/Hide
|
||||
| Activity |
IC50 = 89360 nM
|
[11] | |||
| Compound Name |
Chembl4170402
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
BDBM50290256; 3alpha-[(beta-D-Glucopyranosyl)oxy]-7alpha,12alpha-dihydroxy-5beta-cholanic acid
Click to Show/Hide
|
||||
| Activity |
EC50 = 91500 nM
|
[10] | |||
| Compound Name |
7-(4-Acetyl-2-ethyl-5-hydroxyphenoxy)-2,2-dimethylheptanoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL53417; SCHEMBL9417773; BDBM50446722; L002884
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[11] | |||
| Compound Name |
3-Tert-butyl-4-hydroxyphenyl phenylacetate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
Benzeneacetic acid, 3-(1,1-dimethylethyl)-4-hydroxyphenyl ester; ACMC-20lwud; MLS001178964; CHEMBL1548044; CTK3F6931; DTXSID80356911; HMS2832B16; ZINC363940; MCULE-3696329392; SMR000477323; AN-652/42190862
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(3-Tert-Butyl-4-hydroxyphenyl)-2,6-dichloro-4-piperazinobenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613437
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2-[3-[(4-Methylphenyl)carbamoyl]-4-piperidin-1-ylphenyl]indazole-6-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3746821; SCHEMBL17317386; BDBM50500150
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
INT-777 R-enantiomer
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
INT-777 (R-enantiomer); CHEMBL565278; SCHEMBL592022; BDBM50300200; HY-15677A; ZINC49670165; CS-6130; 6alpha-ethyl-23(R)-methyl-cholic acid
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[14] | |||
| Compound Name |
(3-Tert-butyl-4-hydroxyphenyl) 2-methoxybenzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613411
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(3-Tert-butyl-4-prop-2-enoxyphenyl)-2,4-dichlorobenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613424
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(3-Tert-butyl-4-hydroxyphenyl) (E)-3-phenylprop-2-enoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613278
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(3-Tert-Butyl-4-hydroxyphenyl)-2,6-dichloro-4-piperidinobenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613436
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(3-Tert-butyl-4-hydroxyphenyl) benzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL7711664; 4-benzoyloxy-2-tert-butylphenol; CHEMBL3613409; ZINC363905; 3-tert-butyl-4-hydroxyphenyl benzoate; MCULE-2577359194; AN-652/42190711
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3alpha,7alpha,12alpha-Trihydroxy-6alpha-ethyl-5beta-cholan-24-oic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL567835; SCHEMBL6660233; BDBM50300201
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[14] | |||
| Compound Name |
12-O-Deacetyl-12-epi-19-deoxy-22-hydroxyscalarin
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL438521; BDBM50226464
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[5] | |||
| Compound Name |
(2S,4R)-4-[(3R,7R,8R,9S,10S,13R,14S,17R)-3,7-Dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylpentanoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL244783
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[15] | |||
| Compound Name |
N-(3-Tert-Butyl-4-hydroxyphenyl)-2,6-dichloro-4-(methylcyclohexylamino)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613435
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2,4-Dichloro-N-(3-ethyl-4-hydroxyphenyl)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613421
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3-Tert-butyl-4-hydroxyphenyl 4-methylbenzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613407; ZINC363894; MCULE-6375391994; AN-652/42190676
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2,4-Dichloro-N-(3,5-ditert-butyl-4-hydroxyphenyl)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613419
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(3-Tert-butyl-4-methoxyphenyl)-2,4-dichlorobenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613423
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2,4-Dichloro-N-(4-hydroxy-3-propan-2-ylphenyl)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613420
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(3-Tert-butyl-4-hydroxyphenyl)-2,6-dichloro-N-cyclohexyl-4-(dimethylamino)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613441
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(3-Tert-butyl-4-hydroxyphenyl) 4-chlorobenzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL9453262; CHEMBL3613408; ZINC363909; MCULE-2783760114; 3-tert-butyl-4-hydroxyphenyl 4-chlorobenzoate; AN-652/42190726
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(3-Tert-butyl-4-hydroxyphenyl)-2,6-dichloro-N-(cyclohexylmethyl)-4-(dimethylamino)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613440
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3-Tert-butyl-4-hydroxyphenyl 2-methylbenzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613410; ZINC363922; MCULE-2151430876; AN-652/42190793
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3-Tert-butyl-4-hydroxyphenyl 2-furoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613279; ZINC363925; MCULE-2746112710; AN-652/42190802
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3 alpha-Hydroxy-7 alpha-fluoro-5 beta-cholan-24-oic a
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL273087; BDBM50375555
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[1] | |||
| Compound Name |
(2S,4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-Dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]-2-methylpentanoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL592933; CHEMBL583611; BDBM21676; 23(S)-methyl-BA derivative, 7a; 23(S)-methyl-chenodeoxycholic acid; 23(S)-Methyl-3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[14] | |||
| Compound Name |
3alpha,7beta-Dihydroxy-5beta-cholane-24-sulfonic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3138525
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[1] | |||
| Compound Name |
Avicholic Acid Sodium Salt
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062551
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
2,4-Dichloro-N-(4-hydroxy-3-methylphenyl)benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3613422; AKOS020146085
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3alpha,7alpha-Dihydroxy-5beta-cholane-24-sulfonic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL406923; BDBM50375551; Q27225207; (3alpha,5beta,7alpha)-3,7-dihydroxycholane-24-sulfonic acid
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[1] | |||
| Compound Name |
2-[(1S,2S)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-2-methylbutyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4099184; BDBM50230999
Click to Show/Hide
|
||||
| Activity |
IC50 = 102200 nM
|
[9] | |||
| Compound Name |
2-[(1S)-1-[4,4-Dimethyl-2,5-dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-3-methylbutyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4078435; BDBM50231005
Click to Show/Hide
|
||||
| Activity |
IC50 = 104600 nM
|
[9] | |||
| Compound Name |
2-[(1S)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-3-methylbutyl]-1-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4067531; BDBM50230991
Click to Show/Hide
|
||||
| Activity |
IC50 = 112900 nM
|
[9] | |||
| Compound Name |
2-[(1R)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-2-methylpropyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4065703; BDBM50230995
Click to Show/Hide
|
||||
| Activity |
IC50 = 118500 nM
|
[9] | |||
| Compound Name |
2-[(1S)-1-[3-(4-Cyclohexyloxyphenyl)-2,5-dioxoimidazolidin-1-yl]-3-methylbutyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4087950; BDBM50231002
Click to Show/Hide
|
||||
| Activity |
IC50 = 125500 nM
|
[9] | |||
| Compound Name |
3-[(1S)-2-Cyclohexyl-1-(1,6-dimethylbenzimidazol-2-yl)ethyl]-1-(4-phenoxyphenyl)imidazolidine-2,4-dione
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4103694; BDBM50231013; J3.614.939F
Click to Show/Hide
|
||||
| Activity |
IC50 = 126100 nM
|
[9] | |||
| Compound Name |
(4R,6S)-3-Methyl-1-(2-methylphenyl)-4-(4-phenoxyphenyl)-6-propyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2398210; BDBM50436141
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 150000 nM
|
[16] | |||
| Compound Name |
(4S,6R)-3,6-Dimethyl-1-(2-methylphenyl)-4-(4-phenoxyphenyl)-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2398205; BDBM50436146
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 150000 nM
|
[16] | |||
| Compound Name |
(4R,6S)-6-Methyl-1-(2-methylphenyl)-4-(4-phenoxyphenyl)-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2398206; BDBM50436145
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 150000 nM
|
[16] | |||
| Compound Name |
(4S,6S)-3,6-Dimethyl-1-(2-methylphenyl)-4-(4-phenoxyphenyl)-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2398211; BDBM50436148
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 150000 nM
|
[16] | |||
| Compound Name |
(4R,6R)-3,6-Dimethyl-1-(2-methylphenyl)-4-(4-phenoxyphenyl)-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2398204; BDBM50436147
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 150000 nM
|
[16] | |||
| Compound Name |
2-[(1S)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]-2-methylpropyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4095696; BDBM50230994
Click to Show/Hide
|
||||
| Activity |
IC50 = 174500 nM
|
[9] | |||
| Compound Name |
(E)-3-(3-{Cyclohexanecarbonyl-[4-((E)-3-ethoxy-propenyl)-benzyl]-amino}-phenyl)-acrylic acid methyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL191741; BDBM50167225
Click to Show/Hide
|
||||
| Activity |
EC50 = 198000 nM
|
[17] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 6 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
2-[(1S)-1-[2,5-Dioxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]propyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4060674; BDBM50230997
Click to Show/Hide
|
||||
| Activity |
IC50 = 209500 nM
|
[9] | |||
| Compound Name |
(E)-3-{3-[(4-Benzo[1,3]dioxol-5-yl-benzyl)-cyclohexanecarbonyl-amino]-phenyl}-acrylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL364715; BDBM50171846
Click to Show/Hide
|
||||
| Activity |
EC50 = 222000 nM
|
[18] | |||
| Compound Name |
(E)-3-[3-[Cyclohexanecarbonyl-[[4-[4-(dimethylamino)phenyl]phenyl]methyl]amino]phenyl]prop-2-enoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL189941; SCHEMBL18640456; SCHEMBL18640556; BDBM50171847; (E)-3-{3-[Cyclohexanecarbonyl-(4''-dimethylamino-biphenyl-4-ylmethyl)-amino]-phenyl}-acrylic acid
Click to Show/Hide
|
||||
| Activity |
EC50 = 255000 nM
|
[18] | |||
| Compound Name |
(E)-3-{3-[Cyclohexanecarbonyl-(4-styryl-benzyl)-amino]-phenyl}-acrylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL193020; BDBM50171848
Click to Show/Hide
|
||||
| Activity |
EC50 = 255000 nM
|
[18] | |||
| Compound Name |
2-[(1S)-1-[3-(4-Fluorophenyl)-2,5-dioxoimidazolidin-1-yl]-3-methylbutyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4094951; BDBM50231004
Click to Show/Hide
|
||||
| Activity |
IC50 = 398800 nM
|
[9] | |||
| Compound Name |
2-[(1S)-1-[2,5-Dioxo-4-(4-phenoxyphenyl)piperazin-1-yl]-3-methylbutyl]-3-methylbenzimidazole-5-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4086295; BDBM50231223
Click to Show/Hide
|
||||
| Activity |
IC50 = 417500 nM
|
[9] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Novel potent and selective bile acid derivatives as TGR5 agonists: biological screening, structure-activity relationships, and molecular modeling studies. J Med Chem. 2008 Mar 27;51(6):1831-41. | ||||
| REF 2 | Avicholic Acid: A Lead Compound from Birds on the Route to Potent TGR5 Modulators. ACS Med Chem Lett. 2012 Feb 6;3(4):273-7. | ||||
| REF 3 | E297G mutated bile salt export pump (BSEP) function enhancers derived from GW4064: structural development study and separation from farnesoid X receptor-agonistic activity. Bioorg Med Chem Lett. 2012 Jun 15;22(12):3962-6. | ||||
| REF 4 | Design of Gut-Restricted Thiazolidine Agonists of G Protein-Coupled Bile Acid Receptor 1 (GPBAR1, TGR5). J Med Chem. 2018 Sep 13;61(17):7589-7613. | ||||
| REF 5 | Scalarane sesterterpenes from a marine sponge of the genus Spongia and their FXR antagonistic activity. J Nat Prod. 2007 Nov;70(11):1691-5. | ||||
| REF 6 | Bile acid derivatives as ligands of the farnesoid X receptor. Synthesis, evaluation, and structure-activity relationship of a series of body and side chain modified analogues of chenodeoxycholic acid. J Med Chem. 2004 Aug 26;47(18):4559-69. | ||||
| REF 7 | Nonacidic Chemotype Possessing N-Acylated Piperidine Moiety as Potent Farnesoid X Receptor (FXR) Antagonists. ACS Med Chem Lett. 2018 Jan 4;9(2):78-83. | ||||
| REF 8 | Farnesoid X-activated receptor antagonists from a marine sponge Spongia sp. Bioorg Med Chem Lett. 2006 Oct 15;16(20):5398-402. | ||||
| REF 9 | Discovery and optimization of benzimidazole derivatives as a novel chemotype of farnesoid X receptor (FXR) antagonists. Bioorg Med Chem. 2017 Mar 15;25(6):1787-1794. | ||||
| REF 10 | Synthesis, physicochemical properties, and biological activity of bile acids 3-glucuronides: Novel insights into bile acid signalling and detoxification. Eur J Med Chem. 2018 Jan 20;144:349-358. | ||||
| REF 11 | Discovery and SAR study of hydroxyacetophenone derivatives as potent, non-steroidal farnesoid X receptor (FXR) antagonists. Bioorg Med Chem. 2014 Mar 1;22(5):1596-607. | ||||
| REF 12 | Discovery and SAR study of 3-(tert-butyl)-4-hydroxyphenyl benzoate and benzamide derivatives as novel farnesoid X receptor (FXR) antagonists. Bioorg Med Chem. 2015 Oct 1;23(19):6427-36. | ||||
| REF 13 | Structure-activity relationships for lipoprotein lipase agonists that lower plasma triglycerides in vivo. Eur J Med Chem. 2015 Oct 20;103:191-209. | ||||
| REF 14 | Discovery of 6alpha-ethyl-23(S)-methylcholic acid (S-EMCA, INT-777) as a potent and selective agonist for the TGR5 receptor, a novel target for diabesity. J Med Chem. 2009 Dec 24;52(24):7958-61. | ||||
| REF 15 | Nongenomic actions of bile acids. Synthesis and preliminary characterization of 23- and 6,23-alkyl-substituted bile acid derivatives as selective modulators for the G-protein coupled receptor TGR5. J Med Chem. 2007 Sep 6;50(18):4265-8. | ||||
| REF 16 | Asymmetric synthesis of the four diastereoisomers of a novel non-steroidal farnesoid X receptor (FXR) agonist: role of the chirality on the biological activity. Bioorg Med Chem. 2013 Jul 1;21(13):3780-9. | ||||
| REF 17 | Hologram quantitative structure-activity relationships for a series of farnesoid X receptor activators. Bioorg Med Chem Lett. 2005 Jun 15;15(12):3119-25. | ||||
| REF 18 | Farnesoid X receptor: from structure to potential clinical applications. J Med Chem. 2005 Aug 25;48(17):5383-403. | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.