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Compile Data Set for Download or QSAR

Found 71 hits Enz. Inhib. hit(s) with Target = 'Steroid 5-alpha-reductase' AND taxid = 10116   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50031895
PNG
((1S,9aR,11aS)-9a,11a-Dimethyl-7-oxo-2,3,3a,3b,4,5,...)
Show SMILES C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)NC1(CCCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C30H39ClN2O2/c1-28-16-12-24-22(18-32-26-17-21(34)11-15-29(24,26)2)23(28)9-10-25(28)27(35)33-30(13-3-4-14-30)19-5-7-20(31)8-6-19/h5-8,22-25H,3-4,9-18H2,1-2H3,(H,33,35)/t22?,23?,24?,25-,28+,29-/m1/s1
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0.0700n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibition of recombinant Steroid 5-alpha-reductase type I was evaluated as binding affinity (in vitro)


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50031877
PNG
((1S,9aR,11aS)-9a,11a-Dimethyl-7-oxo-2,3,3a,3b,4,5,...)
Show SMILES CC(C)(C)c1ccc(cc1NC(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C)C(F)(F)F
Show InChI InChI=1S/C30H39F3N2O2/c1-27(2,3)22-7-6-17(30(31,32)33)14-24(22)35-26(37)23-9-8-20-19-16-34-25-15-18(36)10-12-29(25,5)21(19)11-13-28(20,23)4/h6-7,14,19-21,23H,8-13,15-16H2,1-5H3,(H,35,37)/t19?,20?,21?,23-,28+,29-/m1/s1
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0.100n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibition of recombinant Steroid 5-alpha-reductase type I was evaluated as binding affinity of the compound


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50031895
PNG
((1S,9aR,11aS)-9a,11a-Dimethyl-7-oxo-2,3,3a,3b,4,5,...)
Show SMILES C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)NC1(CCCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C30H39ClN2O2/c1-28-16-12-24-22(18-32-26-17-21(34)11-15-29(24,26)2)23(28)9-10-25(28)27(35)33-30(13-3-4-14-30)19-5-7-20(31)8-6-19/h5-8,22-25H,3-4,9-18H2,1-2H3,(H,33,35)/t22?,23?,24?,25-,28+,29-/m1/s1
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0.120n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity was measured on rat Steroid 5-alpha-reductase type 2


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50031877
PNG
((1S,9aR,11aS)-9a,11a-Dimethyl-7-oxo-2,3,3a,3b,4,5,...)
Show SMILES CC(C)(C)c1ccc(cc1NC(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C)C(F)(F)F
Show InChI InChI=1S/C30H39F3N2O2/c1-27(2,3)22-7-6-17(30(31,32)33)14-24(22)35-26(37)23-9-8-20-19-16-34-25-15-18(36)10-12-29(25,5)21(19)11-13-28(20,23)4/h6-7,14,19-21,23H,8-13,15-16H2,1-5H3,(H,35,37)/t19?,20?,21?,23-,28+,29-/m1/s1
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0.170n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity was measured on rat Steroid 5-alpha-reductase type 2


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50031896
PNG
((1S,9aR,11aS)-9a,11a-Dimethyl-7-oxo-2,3,3a,3b,4,5,...)
Show SMILES C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C27H30F6N2O2/c1-24-10-8-18-16(13-34-22-12-15(36)7-9-25(18,22)2)17(24)5-6-20(24)23(37)35-21-11-14(26(28,29)30)3-4-19(21)27(31,32)33/h3-4,11,16-18,20H,5-10,12-13H2,1-2H3,(H,35,37)/t16?,17?,18?,20-,24+,25-/m1/s1
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0.270n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibition of recombinant Steroid 5-alpha-reductase type I was evaluated as binding affinity of the compound


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50031896
PNG
((1S,9aR,11aS)-9a,11a-Dimethyl-7-oxo-2,3,3a,3b,4,5,...)
Show SMILES C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C27H30F6N2O2/c1-24-10-8-18-16(13-34-22-12-15(36)7-9-25(18,22)2)17(24)5-6-20(24)23(37)35-21-11-14(26(28,29)30)3-4-19(21)27(31,32)33/h3-4,11,16-18,20H,5-10,12-13H2,1-2H3,(H,35,37)/t16?,17?,18?,20-,24+,25-/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity was measured on rat Steroid 5-alpha-reductase type 2


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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6.80n/an/an/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibition of recombinant Steroid 5-alpha-reductase type I was evaluated as binding affinity (in vitro)


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50368782
PNG
(Bexlosteride | CHEMBL24955 | LY-191704)
Show SMILES CN1[C@@H]2CCc3cc(Cl)ccc3[C@H]2CCC1=O
Show InChI InChI=1S/C14H16ClNO/c1-16-13-6-2-9-8-10(15)3-4-11(9)12(13)5-7-14(16)17/h3-4,8,12-13H,2,5-7H2,1H3/t12-,13-/m1/s1
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8n/an/an/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL


Assay Description
Binding affinity on rat 5-alpha reductase-1 isozyme


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50289143
PNG
((5R,10R,14S)-17-(2-Hydroxy-1-methyl-ethyl)-10-meth...)
Show SMILES CC(CO)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C(=[N+]=[N-])C(=O)CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C22H34N2O2/c1-13(12-25)15-6-7-16-14-4-5-18-20(24-23)19(26)9-11-22(18,3)17(14)8-10-21(15,16)2/h13-18,25H,4-12H2,1-3H3/t13?,14-,15+,16-,17-,18-,21+,22+/m0/s1
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35n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Apparent inhibitory activity of the compound was determined against rat prostatic Steroid 5-alpha-reductase type I


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50368782
PNG
(Bexlosteride | CHEMBL24955 | LY-191704)
Show SMILES CN1[C@@H]2CCc3cc(Cl)ccc3[C@H]2CCC1=O
Show InChI InChI=1S/C14H16ClNO/c1-16-13-6-2-9-8-10(15)3-4-11(9)12(13)5-7-14(16)17/h3-4,8,12-13H,2,5-7H2,1H3/t12-,13-/m1/s1
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1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL


Assay Description
Binding affinity on rat 5-alpha reductase-2 isozyme


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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n/an/a 0.280n/an/an/an/an/an/a



Glaxo Inc. Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity was measured on rat Steroid 5-alpha-reductase type 2


J Med Chem 38: 2621-7 (1995)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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n/an/a 4.20n/an/an/an/an/an/a



Kingston University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibitory activity against Steroid 5-alpha-reductase type 1 in rat


Bioorg Med Chem Lett 8: 409-14 (1999)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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n/an/a 10n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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n/an/a 11n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116424
PNG
(CHEMBL115438 | {4-[1-(2,2-Dicyclohexyl-acetyl)-pip...)
Show SMILES OC(=O)Cc1ccc(C=C2CCN(CC2)C(=O)C(C2CCCCC2)C2CCCCC2)c(F)c1
Show InChI InChI=1S/C28H38FNO3/c29-25-18-21(19-26(31)32)11-12-24(25)17-20-13-15-30(16-14-20)28(33)27(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h11-12,17-18,22-23,27H,1-10,13-16,19H2,(H,31,32)
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n/an/a 38n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50043604
PNG
((8S,9S,10R,13S,14S,17S)-17-(tert-butylcarbamoyl)-1...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C=C(CC[C@]4(C)[C@H]3CC[C@]12C)C(O)=O
Show InChI InChI=1S/C25H37NO3/c1-23(2,3)26-21(27)20-9-8-18-17-7-6-16-14-15(22(28)29)10-12-24(16,4)19(17)11-13-25(18,20)5/h6,14,17-20H,7-13H2,1-5H3,(H,26,27)(H,28,29)/t17-,18-,19-,20+,24-,25-/m0/s1
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n/an/a 45n/an/an/an/an/an/a



Universität des Saarlandes

Curated by ChEMBL


Assay Description
Inhibitory activity against rat Steroid 5-alpha-reductase type I using 18213 3H testosterone 210 nM as substrate


Bioorg Med Chem Lett 9: 1601-6 (1999)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116429
PNG
(4-[1-(2,2-Dicyclohexyl-acetyl)-piperidin-4-ylidene...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(C2CCCCC2)C2CCCCC2)cc1
Show InChI InChI=1S/C27H37NO3/c29-26(25(22-7-3-1-4-8-22)23-9-5-2-6-10-23)28-17-15-21(16-18-28)19-20-11-13-24(14-12-20)27(30)31/h11-14,19,22-23,25H,1-10,15-18H2,(H,30,31)
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n/an/a 80n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50344122
PNG
((N-tert-butyl-N-((4aR,4bS,6aS,7S,9aS,9bS)-4a,6a-di...)
Show SMILES CC(C)(C)N(C(=O)C1CSCN1C(=O)C1CCC(=O)N1)C(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C32H46N4O5S/c1-30(2,3)36(29(41)23-16-42-17-35(23)28(40)22-9-11-25(37)33-22)27(39)21-8-7-19-18-6-10-24-32(5,15-13-26(38)34-24)20(18)12-14-31(19,21)4/h13,15,18-24H,6-12,14,16-17H2,1-5H3,(H,33,37)(H,34,38)/t18-,19-,20-,21+,22?,23?,24+,31-,32+/m0/s1
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n/an/a 88.0n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of rat 5-alpha-reductase type 2 by Lineweaver-Burk plot


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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n/an/a 147n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of rat 5-alpha-reductase type 2 by Lineweaver-Burk plot


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50057482
PNG
(4-(2-{4-[(S)-1-(4-Isobutyl-phenyl)-ethoxy]-2,3-dim...)
Show SMILES CC(C)Cc1ccc(cc1)[C@H](C)Oc1ccc(C(=O)Nc2ccccc2OCCCC(O)=O)c(C)c1C
Show InChI InChI=1S/C31H37NO5/c1-20(2)19-24-12-14-25(15-13-24)23(5)37-28-17-16-26(21(3)22(28)4)31(35)32-27-9-6-7-10-29(27)36-18-8-11-30(33)34/h6-7,9-10,12-17,20,23H,8,11,18-19H2,1-5H3,(H,32,35)(H,33,34)/t23-/m0/s1
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n/an/a 180n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibitory activity against type 1 5-alpha reductase Isozyme homogenated from rat epididymis


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50032297
PNG
(4-[2-((E)-3-{1-[Bis-(4-fluoro-phenyl)-methyl]-1H-i...)
Show SMILES C\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C35H30F2N2O4/c1-23(21-33(40)38-30-5-2-3-6-32(30)43-20-4-7-34(41)42)26-12-17-31-27(22-26)18-19-39(31)35(24-8-13-28(36)14-9-24)25-10-15-29(37)16-11-25/h2-3,5-6,8-19,21-22,35H,4,7,20H2,1H3,(H,38,40)(H,41,42)/b23-21+
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n/an/a 210n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibitory activity against type 2 5-alpha reductase isozyme homogenated from rat epididymis


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055150
PNG
(4-[2-((E)-3-{1-[Bis-(4-fluoro-phenyl)-methyl]-1H-i...)
Show SMILES CC\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C36H32F2N2O4/c1-2-24(23-34(41)39-31-6-3-4-7-33(31)44-21-5-8-35(42)43)27-13-18-32-28(22-27)19-20-40(32)36(25-9-14-29(37)15-10-25)26-11-16-30(38)17-12-26/h3-4,6-7,9-20,22-23,36H,2,5,8,21H2,1H3,(H,39,41)(H,42,43)/b24-23+
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n/an/a 280n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibitory activity against type 2 5-alpha reductase Isozyme homogenated from rat epididymis


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116423
PNG
(4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-ben...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C27H25NO3/c29-26(25(22-7-3-1-4-8-22)23-9-5-2-6-10-23)28-17-15-21(16-18-28)19-20-11-13-24(14-12-20)27(30)31/h1-14,19,25H,15-18H2,(H,30,31)
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n/an/a 370n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50287684
PNG
((4aR,6aS,7S)-4a,6a-Dimethyl-2-oxo-2,4a,4b,5,6,6a,7...)
Show SMILES CCN(CCCCNC(=O)[C@H]1CCC2C3CCC4NC(=O)C=C[C@]4(C)C3CC[C@]12C)c1ccc2c(c1)c(=O)[nH][nH]c2=O
Show InChI InChI=1S/C33H45N5O4/c1-4-38(20-7-8-21-23(19-20)30(41)37-36-29(21)40)18-6-5-17-34-31(42)26-11-10-24-22-9-12-27-33(3,16-14-28(39)35-27)25(22)13-15-32(24,26)2/h7-8,14,16,19,22,24-27H,4-6,9-13,15,17-18H2,1-3H3,(H,34,42)(H,35,39)(H,36,40)(H,37,41)/t22?,24?,25?,26-,27?,32+,33-/m1/s1
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n/an/a 500n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for its inhibitory potency against rat Steroid 5-alpha-reductase type 1 expressed in transformed yeast Saccharomyces cerevesiae


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116417
PNG
(4-(1-Diphenylcarbamoyl-piperidin-4-ylidenemethyl)-...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)N(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C26H24N2O3/c29-25(30)22-13-11-20(12-14-22)19-21-15-17-27(18-16-21)26(31)28(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,19H,15-18H2,(H,29,30)
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n/an/a 540n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116417
PNG
(4-(1-Diphenylcarbamoyl-piperidin-4-ylidenemethyl)-...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)N(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C26H24N2O3/c29-25(30)22-13-11-20(12-14-22)19-21-15-17-27(18-16-21)26(31)28(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,19H,15-18H2,(H,29,30)
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n/an/a 690n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055148
PNG
(4-(2-{(E)-3-[1-(1-Propyl-butyl)-1H-indol-5-yl]-pen...)
Show SMILES CCCC(CCC)n1ccc2cc(ccc12)C(\CC)=C\C(=O)Nc1ccccc1OCCCC(O)=O
Show InChI InChI=1S/C30H38N2O4/c1-4-10-25(11-5-2)32-18-17-24-20-23(15-16-27(24)32)22(6-3)21-29(33)31-26-12-7-8-13-28(26)36-19-9-14-30(34)35/h7-8,12-13,15-18,20-21,25H,4-6,9-11,14,19H2,1-3H3,(H,31,33)(H,34,35)/b22-21+
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n/an/a 750n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibitory activity against type 2 5-alpha reductase Isozyme homogenated from rat epididymis


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116422
PNG
(4-[1-(3,3-Diphenyl-propionyl)-piperidin-4-ylidenem...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)CC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C28H27NO3/c30-27(20-26(23-7-3-1-4-8-23)24-9-5-2-6-10-24)29-17-15-22(16-18-29)19-21-11-13-25(14-12-21)28(31)32/h1-14,19,26H,15-18,20H2,(H,31,32)
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n/an/a 880n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116428
PNG
(4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-3-m...)
Show SMILES COc1cc(ccc1C=C1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1)C(O)=O
Show InChI InChI=1S/C28H27NO4/c1-33-25-19-24(28(31)32)13-12-23(25)18-20-14-16-29(17-15-20)27(30)26(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18-19,26H,14-17H2,1H3,(H,31,32)
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n/an/a 940n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116432
PNG
(4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-3-f...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(c2ccccc2)c2ccccc2)c(F)c1
Show InChI InChI=1S/C27H24FNO3/c28-24-18-23(27(31)32)12-11-22(24)17-19-13-15-29(16-14-19)26(30)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,17-18,25H,13-16H2,(H,31,32)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116432
PNG
(4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-3-f...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(c2ccccc2)c2ccccc2)c(F)c1
Show InChI InChI=1S/C27H24FNO3/c28-24-18-23(27(31)32)12-11-22(24)17-19-13-15-29(16-14-19)26(30)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,17-18,25H,13-16H2,(H,31,32)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50180893
PNG
((3-methyl-4-(4-phenoxybenzoyl)phenyl)acetic acid |...)
Show SMILES Cc1cc(CC(O)=O)ccc1C(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C22H18O4/c1-15-13-16(14-21(23)24)7-12-20(15)22(25)17-8-10-19(11-9-17)26-18-5-3-2-4-6-18/h2-13H,14H2,1H3,(H,23,24)
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n/an/a 1.45E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Displacement of [3H]-androstenedione from 5alpha reductase1 in rat ventral prostrate homogenate at pH 6.6


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116422
PNG
(4-[1-(3,3-Diphenyl-propionyl)-piperidin-4-ylidenem...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)CC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C28H27NO3/c30-27(20-26(23-7-3-1-4-8-23)24-9-5-2-6-10-24)29-17-15-22(16-18-29)19-21-11-13-25(14-12-21)28(31)32/h1-14,19,26H,15-18,20H2,(H,31,32)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116419
PNG
(4-[1-(2,2-Dicyclohexyl-acetyl)-piperidin-4-ylidene...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(C2CCCCC2)C2CCCCC2)c(F)c1
Show InChI InChI=1S/C27H36FNO3/c28-24-18-23(27(31)32)12-11-22(24)17-19-13-15-29(16-14-19)26(30)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h11-12,17-18,20-21,25H,1-10,13-16H2,(H,31,32)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against steroid Steroid 5-alpha-reductase type I of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116428
PNG
(4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-3-m...)
Show SMILES COc1cc(ccc1C=C1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1)C(O)=O
Show InChI InChI=1S/C28H27NO4/c1-33-25-19-24(28(31)32)13-12-23(25)18-20-14-16-29(17-15-20)27(30)26(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18-19,26H,14-17H2,1H3,(H,31,32)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50334788
PNG
((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
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n/an/a 2.10E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibitory activity against type 2 5-alpha reductase Isozyme homogenated from rat epididymis


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50032282
PNG
(4-(2-{(E)-3-[1-(1-Propyl-butyl)-1H-indol-5-yl]-but...)
Show SMILES CCCC(CCC)n1ccc2cc(ccc12)C(\C)=C\C(=O)Nc1ccccc1OCCCC(O)=O
Show InChI InChI=1S/C29H36N2O4/c1-4-9-24(10-5-2)31-17-16-23-20-22(14-15-26(23)31)21(3)19-28(32)30-25-11-6-7-12-27(25)35-18-8-13-29(33)34/h6-7,11-12,14-17,19-20,24H,4-5,8-10,13,18H2,1-3H3,(H,30,32)(H,33,34)/b21-19+
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n/an/a 2.30E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116426
PNG
(4-[1-(Adamantane-1-carbonyl)-piperidin-4-ylideneme...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C23CC4CC(CC(C4)C2)C3)cc1
Show InChI InChI=1S/C24H29NO3/c26-22(27)21-3-1-16(2-4-21)9-17-5-7-25(8-6-17)23(28)24-13-18-10-19(14-24)12-20(11-18)15-24/h1-4,9,18-20H,5-8,10-15H2,(H,26,27)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055147
PNG
(4-{2-[(E)-3-(1-Benzhydryl-1H-indol-5-yl)-pent-2-en...)
Show SMILES CC\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C36H34N2O4/c1-2-26(25-34(39)37-31-16-9-10-17-33(31)42-23-11-18-35(40)41)29-19-20-32-30(24-29)21-22-38(32)36(27-12-5-3-6-13-27)28-14-7-4-8-15-28/h3-10,12-17,19-22,24-25,36H,2,11,18,23H2,1H3,(H,37,39)(H,40,41)/b26-25+
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n/an/a 2.50E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116416
PNG
(4-[1-(Adamantane-1-carbonyl)-piperidin-4-ylideneme...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C23CC4CC(CC(C4)C2)C3)c(F)c1
Show InChI InChI=1S/C24H28FNO3/c25-21-11-20(22(27)28)2-1-19(21)10-15-3-5-26(6-4-15)23(29)24-12-16-7-17(13-24)9-18(8-16)14-24/h1-2,10-11,16-18H,3-9,12-14H2,(H,27,28)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116419
PNG
(4-[1-(2,2-Dicyclohexyl-acetyl)-piperidin-4-ylidene...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(C2CCCCC2)C2CCCCC2)c(F)c1
Show InChI InChI=1S/C27H36FNO3/c28-24-18-23(27(31)32)12-11-22(24)17-19-13-15-29(16-14-19)26(30)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h11-12,17-18,20-21,25H,1-10,13-16H2,(H,31,32)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116424
PNG
(CHEMBL115438 | {4-[1-(2,2-Dicyclohexyl-acetyl)-pip...)
Show SMILES OC(=O)Cc1ccc(C=C2CCN(CC2)C(=O)C(C2CCCCC2)C2CCCCC2)c(F)c1
Show InChI InChI=1S/C28H38FNO3/c29-25-18-21(19-26(31)32)11-12-24(25)17-20-13-15-30(16-14-20)28(33)27(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h11-12,17-18,22-23,27H,1-10,13-16,19H2,(H,31,32)
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n/an/a 3.20E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055149
PNG
(4-[2-((E)-3-{1-[Bis-(4-fluoro-phenyl)-methyl]-1H-i...)
Show SMILES OC(=O)CCCOc1ccccc1NC(=O)\C=C(/C1CC1)c1ccc2n(ccc2c1)C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C37H32F2N2O4/c38-29-14-9-25(10-15-29)37(26-11-16-30(39)17-12-26)41-20-19-28-22-27(13-18-33(28)41)31(24-7-8-24)23-35(42)40-32-4-1-2-5-34(32)45-21-3-6-36(43)44/h1-2,4-5,9-20,22-24,37H,3,6-8,21H2,(H,40,42)(H,43,44)/b31-23+
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n/an/a 3.40E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116423
PNG
(4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-ben...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C27H25NO3/c29-26(25(22-7-3-1-4-8-22)23-9-5-2-6-10-23)28-17-15-21(16-18-28)19-20-11-13-24(14-12-20)27(30)31/h1-14,19,25H,15-18H2,(H,30,31)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116416
PNG
(4-[1-(Adamantane-1-carbonyl)-piperidin-4-ylideneme...)
Show SMILES OC(=O)c1ccc(C=C2CCN(CC2)C(=O)C23CC4CC(CC(C4)C2)C3)c(F)c1
Show InChI InChI=1S/C24H28FNO3/c25-21-11-20(22(27)28)2-1-19(21)10-15-3-5-26(6-4-15)23(29)24-12-16-7-17(13-24)9-18(8-16)14-24/h1-2,10-11,16-18H,3-9,12-14H2,(H,27,28)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type 2 of rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055154
PNG
(4-(2-{(E)-3-[1-(1-Propyl-pentyl)-1H-indol-5-yl]-pe...)
Show SMILES CCCCC(CCC)n1ccc2cc(ccc12)C(\CC)=C\C(=O)Nc1ccccc1OCCCC(O)=O
Show InChI InChI=1S/C31H40N2O4/c1-4-7-12-26(11-5-2)33-19-18-25-21-24(16-17-28(25)33)23(6-3)22-30(34)32-27-13-8-9-14-29(27)37-20-10-15-31(35)36/h8-9,13-14,16-19,21-22,26H,4-7,10-12,15,20H2,1-3H3,(H,32,34)(H,35,36)/b23-22+
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n/an/a 3.60E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50032281
PNG
(4-(2-{(E)-3-[1-(1-Propyl-pentyl)-1H-indol-5-yl]-bu...)
Show SMILES CCCCC(CCC)n1ccc2cc(ccc12)C(\C)=C\C(=O)Nc1ccccc1OCCCC(O)=O
Show InChI InChI=1S/C30H38N2O4/c1-4-6-11-25(10-5-2)32-18-17-24-21-23(15-16-27(24)32)22(3)20-29(33)31-26-12-7-8-13-28(26)36-19-9-14-30(34)35/h7-8,12-13,15-18,20-21,25H,4-6,9-11,14,19H2,1-3H3,(H,31,33)(H,34,35)/b22-20+
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n/an/a 4.10E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50116418
PNG
(CHEMBL323856 | [4-(1-Diphenylacetyl-piperidin-4-yl...)
Show SMILES OC(=O)Cc1ccc(C=C2CCN(CC2)C(=O)C(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C28H27NO3/c30-26(31)20-22-13-11-21(12-14-22)19-23-15-17-29(18-16-23)28(32)27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,19,27H,15-18,20H2,(H,30,31)
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n/an/a 4.50E+3n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase type I from rat ventral prostate (RVP)


J Med Chem 45: 3406-17 (2002)

More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055146
PNG
(4-(2-{(E)-3-[1-(1-Isobutyl-3-methyl-butyl)-1H-indo...)
Show SMILES CC\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(CC(C)C)CC(C)C
Show InChI InChI=1S/C32H42N2O4/c1-6-24(21-31(35)33-28-10-7-8-11-30(28)38-17-9-12-32(36)37)25-13-14-29-26(20-25)15-16-34(29)27(18-22(2)3)19-23(4)5/h7-8,10-11,13-16,20-23,27H,6,9,12,17-19H2,1-5H3,(H,33,35)(H,36,37)/b24-21+
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n/an/a 4.80E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
Steroid 5-alpha-reductase


(Rattus norvegicus)
BDBM50055152
PNG
(4-[2-((E)-3-{1-[Bis-(4-fluoro-phenyl)-methyl]-1H-i...)
Show SMILES CCC\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C37H34F2N2O4/c1-2-6-27(24-35(42)40-32-7-3-4-8-34(32)45-22-5-9-36(43)44)28-14-19-33-29(23-28)20-21-41(33)37(25-10-15-30(38)16-11-25)26-12-17-31(39)18-13-26/h3-4,7-8,10-21,23-24,37H,2,5-6,9,22H2,1H3,(H,40,42)(H,43,44)/b27-24+
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n/an/a 4.90E+3n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd.

Curated by ChEMBL


Assay Description
5 alpha- reductase inhibitory activity


Citation and Details
More data for this
Ligand-Target Pair
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