BDBM50214746 CHEMBL539174

SMILES: COc1ccccc1N1CCN(CCC(Oc2ccc(cc2)C(=O)Nc2ccccc2OCCCC(O)=O)c2cccc(C)c2)CC1

InChI Key: InChIKey=NTVHQLDQZALQSO-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50214746   

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 (Rattus norvegicus)	BDBM50214746 (CHEMBL539174) Show SMILES COc1ccccc1N1CCN(CCC(Oc2ccc(cc2)C(=O)Nc2ccccc2OCCCC(O)=O)c2cccc(C)c2)CC1 Show InChI InChI=1S/C38H43N3O6/c1-28-9-7-10-30(27-28)34(20-21-40-22-24-41(25-23-40)33-12-4-6-14-36(33)45-2)47-31-18-16-29(17-19-31)38(44)39-32-11-3-5-13-35(32)46-26-8-15-37(42)43/h3-7,9-14,16-19,27,34H,8,15,20-26H2,1-2H3,(H,39,44)(H,42,43)	MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Zeria Pharmaceutical Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against prostatic 5-alpha reductase in Sprague-Dawley rat				Bioorg Med Chem Lett 8: 2967-72 (1998) BindingDB Entry DOI: 10.7270/Q2K35WVS
					More data for this Ligand-Target Pair