Found 3 hits for monomerid = 50391268 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Steroid 5-alpha-reductase
(Homo sapiens (Human)) | BDBM50391268
(CHEMBL110001)Show SMILES CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4C=C(CC[C@]4(C)C3CC[C@]12C)[N+]([O-])=O |c:17| Show InChI InChI=1S/C26H42N2O3/c1-16(2)27(17(3)4)24(29)23-10-9-21-20-8-7-18-15-19(28(30)31)11-13-25(18,5)22(20)12-14-26(21,23)6/h15-18,20-23H,7-14H2,1-6H3/t18-,20?,21?,22?,23+,25-,26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of type-2 human steroid 5-alpha-reductase. |
Bioorg Med Chem Lett 6: 481-484 (1996)
Article DOI: 10.1016/0960-894X(96)00054-6
BindingDB Entry DOI: 10.7270/Q2BZ661K |
More data for this
Ligand-Target Pair | |
Steroid 5-alpha-reductase
(Homo sapiens (Human)) | BDBM50391268
(CHEMBL110001)Show SMILES CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4C=C(CC[C@]4(C)C3CC[C@]12C)[N+]([O-])=O |c:17| Show InChI InChI=1S/C26H42N2O3/c1-16(2)27(17(3)4)24(29)23-10-9-21-20-8-7-18-15-19(28(30)31)11-13-25(18,5)22(20)12-14-26(21,23)6/h15-18,20-23H,7-14H2,1-6H3/t18-,20?,21?,22?,23+,25-,26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against human prostatic Steroid 5-alpha-reductase |
Bioorg Med Chem Lett 1: 27-32 (1991)
Article DOI: 10.1016/S0960-894X(01)81084-2
BindingDB Entry DOI: 10.7270/Q29P31J1 |
More data for this
Ligand-Target Pair | |
5α-Reductase 1 (5α-R1)
(Homo sapiens (Human)) | BDBM50391268
(CHEMBL110001)Show SMILES CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4C=C(CC[C@]4(C)C3CC[C@]12C)[N+]([O-])=O |c:17| Show InChI InChI=1S/C26H42N2O3/c1-16(2)27(17(3)4)24(29)23-10-9-21-20-8-7-18-15-19(28(30)31)11-13-25(18,5)22(20)12-14-26(21,23)6/h15-18,20-23H,7-14H2,1-6H3/t18-,20?,21?,22?,23+,25-,26-/m0/s1 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 4.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of type-1 human steroid 5-alpha-reductase |
Bioorg Med Chem Lett 6: 481-484 (1996)
Article DOI: 10.1016/0960-894X(96)00054-6
BindingDB Entry DOI: 10.7270/Q2BZ661K |
More data for this
Ligand-Target Pair | |
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