Compile Data Set for Download or QSAR
Found 108 Enz. Inhib. hit(s) with Target = 'Sex hormone-binding globulin'
TargetSex hormone-binding globulin(Rattus norvegicus)
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50367916(METHYLTRIENOLONE | Metribolone | R-1881)
Show SMILES C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C=C[C@]12C
Show InChI InChI=1S/C19H24O2/c1-18-9-7-15-14-6-4-13(20)11-12(14)3-5-16(15)17(18)8-10-19(18,2)21/h7,9,11,16-17,21H,3-6,8,10H2,1-2H3/t16-,17+,18+,19+/m1/s1
Affinity DataIC50: 3.70nMAssay Description:Inhibition of rat androgen binding protein (rABP) (n=9)More data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM18161((1S,2S,7S,10R,11S,14S,15S)-14-hydroxy-2,15-dimethy...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1
Affinity DataIC50: 3.80nMAssay Description:Inhibition of hSHBG (human sex hormone binding globulin )More data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM8885((1S,2R,10R,11S,14S,15S)-14-hydroxy-2,15-dimethylte...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
Affinity DataIC50: 14nMAssay Description:Displacement of [3H]DHT from human SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Rattus norvegicus)
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM18161((1S,2S,7S,10R,11S,14S,15S)-14-hydroxy-2,15-dimethy...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1
Affinity DataIC50: 23nMAssay Description:Inhibition of rat androgen binding protein (rABP)More data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM17292((1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
Affinity DataIC50: 50nMAssay Description:Displacement of [3H]DHT from human SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50200091(8-hydroxy-7a-methyl-4,5,5a,5b,6,7,7a,8,9,10,10a,10...)
Show SMILES CC12CCC3C(CCC4=CC(=O)NCCC34C)C1CCC2O
Show InChI InChI=1S/C19H29NO2/c1-18-9-10-20-17(22)11-12(18)3-4-13-14-5-6-16(21)19(14,2)8-7-15(13)18/h11,13-16,21H,3-10H2,1-2H3,(H,20,22)
Affinity DataIC50: 950nMAssay Description:Displacement of [3H]DHT from human SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50240916((-)-3,4-divanillyltetrahydrofuran | (3R,4R)-3,4-Bi...)
Show SMILES COc1cc(C[C@H]2COC[C@@H]2Cc2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C20H24O5/c1-23-19-9-13(3-5-17(19)21)7-15-11-25-12-16(15)8-14-4-6-18(22)20(10-14)24-2/h3-6,9-10,15-16,21-22H,7-8,11-12H2,1-2H3/t15-,16-/m0/s1
Affinity DataIC50: 2.60E+3nMAssay Description:Displacement of [3H]DHT from human serum SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50200092(4-(4-(3-fluoro-4-hydroxyphenyl)hexan-3-yl)benzene-...)
Show SMILES CCC(C(CC)c1ccc(O)c(F)c1)c1ccc(O)c(O)c1
Show InChI InChI=1S/C18H21FO3/c1-3-13(11-5-7-16(20)15(19)9-11)14(4-2)12-6-8-17(21)18(22)10-12/h5-10,13-14,20-22H,3-4H2,1-2H3
Affinity DataIC50: 1.04E+4nMAssay Description:Displacement of [3H]DHT from human SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50200093(2-(4-hydroxyphenyl)-1-propyl-2,3-dihydro-1H-inden-...)
Show SMILES CCCC1C(Cc2cc(O)ccc12)c1ccc(O)cc1
Show InChI InChI=1S/C18H20O2/c1-2-3-17-16-9-8-15(20)10-13(16)11-18(17)12-4-6-14(19)7-5-12/h4-10,17-20H,2-3,11H2,1H3
Affinity DataIC50: 1.11E+4nMAssay Description:Displacement of [3H]DHT from human SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50166034(1-(2,4-Dihydroxy-phenyl)-2-(4-hydroxy-phenyl)-etha...)
Show SMILES Oc1ccc(CC(=O)c2ccc(O)cc2O)cc1
Show InChI InChI=1S/C14H12O4/c15-10-3-1-9(2-4-10)7-13(17)12-6-5-11(16)8-14(12)18/h1-6,8,15-16,18H,7H2
Affinity DataIC50: 1.36E+4nMAssay Description:Inhibitory concentration against [3H]-DHT binding to human sex hormone-binding globulin (SHBG)More data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50166033(4-((1S,2S,5S,6S,9R)-5-Hydroxymethyl-6,8,9-trimethy...)
Show SMILES COc1cc(ccc1O)[C@H]1OC[C@@]2(CO)[C@@H](C)C=C(C)[C@@H]1[C@H]2C
Show InChI InChI=1S/C19H26O4/c1-11-7-12(2)19(9-20)10-23-18(17(11)13(19)3)14-5-6-15(21)16(8-14)22-4/h5-8,12-13,17-18,20-21H,9-10H2,1-4H3/t12-,13+,17+,18+,19-/m0/s1
Affinity DataIC50: 2.24E+4nMAssay Description:Inhibitory concentration against [3H]-DHT binding to human sex hormone-binding globulin (SHBG)More data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50200090(4-(4-hydroxy-3-(hydroxymethyl)-5-methylbenzyl)-2-(...)
Show SMILES Cc1cc(Cc2cc(C)c(O)c(CO)c2)cc(CO)c1O
Show InChI InChI=1S/C17H20O4/c1-10-3-12(6-14(8-18)16(10)20)5-13-4-11(2)17(21)15(7-13)9-19/h3-4,6-7,18-21H,5,8-9H2,1-2H3
Affinity DataIC50: 4.82E+4nMAssay Description:Displacement of [3H]DHT from human SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50240921((-)-matairesinol | (2R,3R)-2,3-Bis(4-hydroxy-3-met...)
Show SMILES COc1cc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3/t14-,15+/m0/s1
Affinity DataIC50: 5.20E+4nMAssay Description:Displacement of [3H]DHT from human serum SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50166035(4-((1R,2R,5R,6R,9R)-5-Hydroxymethyl-6,8,9-trimethy...)
Show SMILES C[C@@H]1C=C(C)[C@H]2[C@@H](C)[C@]1(CO)CO[C@H]2c1ccc(O)cc1
Show InChI InChI=1S/C18H24O3/c1-11-8-12(2)18(9-19)10-21-17(16(11)13(18)3)14-4-6-15(20)7-5-14/h4-8,12-13,16-17,19-20H,9-10H2,1-3H3/t12-,13-,16+,17+,18-/m1/s1
Affinity DataIC50: 1.25E+5nMAssay Description:Inhibitory concentration against [3H]-DHT binding to human sex hormone-binding globulin (SHBG)More data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50250505((-)-(2R,3R)-Secoisolariciresinol | (-)-secoisolari...)
Show SMILES COc1cc(C[C@@H](CO)[C@H](CO)C(O)c2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C20H26O7/c1-26-18-8-12(3-5-16(18)23)7-14(10-21)15(11-22)20(25)13-4-6-17(24)19(9-13)27-2/h3-6,8-9,14-15,20-25H,7,10-11H2,1-2H3/t14-,15-,20?/m0/s1
Affinity DataIC50: 2.30E+5nMAssay Description:Displacement of [3H]DHT from human serum SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50250487((+/-)-enterolactone | CHEMBL465152)
Show SMILES Oc1cccc(CC2COC(=O)C2Cc2cccc(O)c2)c1
Show InChI InChI=1S/C18H18O4/c19-15-5-1-3-12(8-15)7-14-11-22-18(21)17(14)10-13-4-2-6-16(20)9-13/h1-6,8-9,14,17,19-20H,7,10-11H2
Affinity DataIC50: 6.20E+5nMAssay Description:Displacement of [3H]DHT from human serum SHBGMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423534(4-Methyl-Testosterone | CHEMBL265925)
Show SMILES CC1=C2CC[C@H]3[C@@H]4CC[C@H](O)[C@@]4(C)CC[C@@H]3[C@@]2(C)CCC1=O
Show InChI InChI=1S/C20H30O2/c1-12-14-5-4-13-15-6-7-18(22)20(15,3)10-8-16(13)19(14,2)11-9-17(12)21/h13,15-16,18,22H,4-11H2,1-3H3/t13-,15-,16-,18-,19-,20-/m0/s1
Affinity DataKd:  0.490nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50368998(CHEMBL265926)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)c(I)cc34)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C18H23IO2/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-16(20)15(19)9-13(10)11/h8-9,11-12,14,17,20-21H,2-7H2,1H3/t11-,12+,14-,17-,18-/m0/s1
Affinity DataKd:  0.479nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423535(7Alpha-Methyldihydrotestosterone | CHEMBL411053)
Show SMILES C[C@@H]1C[C@H]2CC(=O)CC[C@]2(C)[C@H]2CC[C@]3(C)[C@@H](O)CC[C@H]3[C@H]12
Show InChI InChI=1S/C20H32O2/c1-12-10-13-11-14(21)6-8-19(13,2)16-7-9-20(3)15(18(12)16)4-5-17(20)22/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13+,15+,16+,17+,18+,19+,20+/m1/s1
Affinity DataKd:  0.417nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423536(17-Ethinyl-Dihydrotestosterone | CHEMBL260202)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC[C@@]2(O)C#C
Show InChI InChI=1S/C21H30O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,14,16-18,23H,5-13H2,2-3H3/t14-,16+,17-,18-,19-,20-,21-/m0/s1
Affinity DataKd:  0.182nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50410532(4-NONYLPHENOL)
Show SMILES CCCCCCCCCc1ccc(O)cc1
Show InChI InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3
Affinity DataKd:  1.20E+3nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50191348((3alpha,5beta)-3-hydroxyandrostan-17-one | 3alpha-...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@H](O)CC[C@]34C)[C@@H]1CCC2=O
Show InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,18+,19+/m1/s1
Affinity DataKd:  708nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50170653((11beta)-11,21-dihydroxypregn-4-ene-3,20-dione | 1...)
Show SMILES C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO
Show InChI InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1
Affinity DataKd:  457nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423537(CHEMBL260658)
Show SMILES C[C@@H]1C=C2CC(O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@]3(C)O)[C@H]12
Show InChI InChI=1S/C21H34O2/c1-13-11-14-12-15(22)5-8-19(14,2)16-6-9-20(3)17(18(13)16)7-10-21(20,4)23/h11,13,15-18,22-23H,5-10,12H2,1-4H3/t13-,15?,16+,17+,18-,19+,20+,21+/m1/s1
Affinity DataKd:  363nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50240921((-)-matairesinol | (2R,3R)-2,3-Bis(4-hydroxy-3-met...)
Show SMILES COc1cc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3/t14-,15+/m0/s1
Affinity DataKd:  309nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423538(CHEMBL259313)
Show SMILES C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C(C)(C)CC4=C3C=C[C@]12C
Show InChI InChI=1S/C21H28O2/c1-19(2)12-16-13(11-18(19)22)5-6-15-14(16)7-9-20(3)17(15)8-10-21(20,4)23/h7,9,11,15,17,23H,5-6,8,10,12H2,1-4H3/t15-,17+,20+,21+/m1/s1
Affinity DataKd:  138nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM17639((1S,2S,5R,7S,10R,11S,15S)-5-hydroxy-2,15-dimethylt...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@@H]1CCC2=O
Show InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1
Affinity DataKd:  71nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423539(11-Deoxycortisol | CORTODOXONE | Cortexolone | SK&...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
Show InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1
Affinity DataKd:  36nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423540(CHEMBL259635)
Show SMILES CC[C@]12CC(=C)C3[C@@H](CCC4=C[C@H](O)CC[C@]34C)[C@@H]1CC[C@@]2(O)C#C
Show InChI InChI=1S/C23H32O2/c1-5-22-14-15(3)20-18(19(22)10-12-23(22,25)6-2)8-7-16-13-17(24)9-11-21(16,20)4/h2,13,17-20,24-25H,3,5,7-12,14H2,1,4H3/t17-,18+,19+,20?,21+,22+,23+/m1/s1
Affinity DataKd:  21nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50148732(17-ethynyl-17beta-hydroxyestr-4-en-3-one | 17alpha...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
Show InChI InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1
Affinity DataKd:  11nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423541(DANAZOL | Danocrine | WIN-17757)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=Cc5oncc5C[C@]34C)[C@@H]1CC[C@@]2(O)C#C
Show InChI InChI=1S/C22H27NO2/c1-4-22(24)10-8-18-16-6-5-15-11-19-14(13-23-25-19)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,13,16-18,24H,5-10,12H2,2-3H3/t16-,17+,18+,20+,21+,22+/m1/s1
Affinity DataKd:  6.30nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423542(CHEMBL261407)
Show SMILES CC[C@]12CC(=C)[C@@H]3[C@H]4CC[C@@H](O)C[C@@H]4C[C@@H](C)[C@H]3[C@@H]1CC[C@@]2(O)C#C
Show InChI InChI=1S/C23H34O2/c1-5-22-13-15(4)20-18-8-7-17(24)12-16(18)11-14(3)21(20)19(22)9-10-23(22,25)6-2/h2,14,16-21,24-25H,4-5,7-13H2,1,3H3/t14-,16+,17-,18+,19+,20-,21+,22+,23+/m1/s1
Affinity DataKd:  5.40nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423543(19-Nor-Dihydrotestosterone | CHEMBL260641)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4CC(=O)CC[C@H]34)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h11,13-17,20H,2-10H2,1H3/t11?,13-,14+,15+,16-,17-,18-/m0/s1
Affinity DataKd:  4.40nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50410531(Android | Android 10 | Android 25 | Android 5 | ME...)
Show SMILES C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C20H30O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h12,15-17,22H,4-11H2,1-3H3/t15-,16+,17+,18+,19+,20+/m1/s1
Affinity DataKd:  3.70nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423544(EQUILIN)
Show SMILES C[C@]12CC[C@H]3C(=CCc4cc(O)ccc34)[C@@H]1CCC2=O
Show InChI InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16,19H,2,6-9H2,1H3/t14-,16+,18+/m1/s1
Affinity DataKd:  3.10nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423545(EQUILENIN)
Show SMILES C[C@]12CCc3c(ccc4cc(O)ccc34)[C@@H]1CCC2=O
Show InChI InChI=1S/C18H18O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,16,19H,6-9H2,1H3/t16-,18-/m0/s1
Affinity DataKd:  2.40nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423546(BOLASTERONE | U-19763)
Show SMILES C[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@]3(C)O)[C@H]12
Show InChI InChI=1S/C21H32O2/c1-13-11-14-12-15(22)5-8-19(14,2)16-6-9-20(3)17(18(13)16)7-10-21(20,4)23/h12-13,16-18,23H,5-11H2,1-4H3/t13-,16+,17+,18-,19+,20+,21+/m1/s1
Affinity DataKd:  1.70nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423547(MESTANOLONE)
Show SMILES C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h13,15-17,22H,4-12H2,1-3H3/t13-,15+,16-,17-,18-,19-,20-/m0/s1
Affinity DataKd:  1.60nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423548(CHEMBL410519)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@@]2(O)C#C
Show InChI InChI=1S/C21H30O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,5,15-18,22-23H,6-13H2,2-3H3/t15-,16+,17-,18-,19-,20-,21-/m0/s1
Affinity DataKd:  1.20nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423549(6Alpha-Fluoro-Dihydrotestosterone | CHEMBL408707)
Show SMILES C[C@]12CC[C@H]3[C@@H](C[C@H](F)[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H29FO2/c1-18-7-5-11(21)9-15(18)16(20)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h12-17,22H,3-10H2,1-2H3/t12-,13-,14-,15+,16-,17-,18+,19-/m0/s1
Affinity DataKd:  0.891nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50093445((3alpha,5alpha,17beta)-androstane-3,17-diol | 3alp...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H32O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,20-21H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17-,18-,19-/m0/s1
Affinity DataKd:  0.776nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM8885((1S,2R,10R,11S,14S,15S)-14-hydroxy-2,15-dimethylte...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
Affinity DataKd:  0.631nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423550(CHEMBL259126)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@H]34)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2,12-17,19-20H,3-10H2,1H3/t12-,13-,14+,15+,16-,17-,18-/m0/s1
Affinity DataKd:  0.288nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423551(MESTEROLONE | SH-723)
Show SMILES C[C@H]1CC(=O)C[C@@H]2CC[C@H]3[C@@H]4CC[C@H](O)[C@@]4(C)CC[C@@H]3[C@@]12C
Show InChI InChI=1S/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19-,20-/m0/s1
Affinity DataKd:  0.251nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50300786(5-[125I]Iodo-3'-O-(17beta-succinyl-5alpha-androsta...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)CCC(=O)O[C@H]1C[C@@H](O[C@@H]1COP(O)(O)=O)n1cc(I)c(=O)[nH]c1=O
Show InChI InChI=1S/C32H44IN2O12P/c1-31-11-9-18(36)13-17(31)3-4-19-20-5-6-25(32(20,2)12-10-21(19)31)47-28(38)8-7-27(37)46-23-14-26(45-24(23)16-44-48(41,42)43)35-15-22(33)29(39)34-30(35)40/h15,17,19-21,23-26H,3-14,16H2,1-2H3,(H,34,39,40)(H2,41,42,43)/t17-,19-,20-,21-,23-,24+,25-,26+,31-,32-/m0/s1
Affinity DataKd:  17.2nMAssay Description:Binding affinity to human sex hormone binding globulin after 30 mins by size-exclusion HPLC analysisMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM18161((1S,2S,7S,10R,11S,14S,15S)-14-hydroxy-2,15-dimethy...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1
Affinity DataKd:  0.182nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423497(CHEMBL265939 | ZINC 00457465[36])
Show SMILES Cc1c(O)ccc(C(=O)Cc2ccccc2Cl)c1O
Show InChI InChI=1S/C15H13ClO3/c1-9-13(17)7-6-11(15(9)19)14(18)8-10-4-2-3-5-12(10)16/h2-7,17,19H,8H2,1H3
Affinity DataKd:  2.19E+3nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM23419((2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro...)
Show SMILES Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1
Show InChI InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1
Affinity DataKd:  955nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423498(CHEMBL265940 | ZINC 00334865)
Show SMILES Oc1ccc(cc1)-c1cc2ccc(O)cc2o1
Show InChI InChI=1S/C14H10O3/c15-11-4-1-9(2-5-11)13-7-10-3-6-12(16)8-14(10)17-13/h1-8,15-16H
Affinity DataKd:  832nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
TargetSex hormone-binding globulin(Homo sapiens (Human))
Sterling Research Group

Curated by ChEMBL
LigandPNGBDBM50423499(CHEMBL259383 | ZINC 02819939)
Show SMILES COc1cc(\C=N\CCc2ccccc2)ccc1O
Show InChI InChI=1S/C16H17NO2/c1-19-16-11-14(7-8-15(16)18)12-17-10-9-13-5-3-2-4-6-13/h2-8,11-12,18H,9-10H2,1H3/b17-12+
Affinity DataKd:  589nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
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