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SMILES: CCCCC(CCCC)n1ccc2cc(ccc12)C(\C)=C\C(=O)Nc1ccccc1OCCCC(O)=O

InChI Key: InChIKey=KAKWGRPFGRJRLQ-XTQSDGFTSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50470271   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
3-oxo-5-alpha-steroid 4-dehydrogenase 1/2


(Rattus norvegicus)		BDBM50470271
PNG
(CHEMBL327722)
Show SMILES CCCCC(CCCC)n1ccc2cc(ccc12)C(\C)=C\C(=O)Nc1ccccc1OCCCC(O)=O
Show InChI InChI=1S/C31H40N2O4/c1-4-6-11-26(12-7-5-2)33-19-18-25-22-24(16-17-28(25)33)23(3)21-30(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)/b23-21+
MMDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 21n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd

Curated by ChEMBL


Assay Description
Inhibitory activity against Steroid 5-alpha-reductase in prostates from male rats

J Med Chem 38: 2887-92 (1995)


Article DOI: 10.1021/jm00015a011
BindingDB Entry DOI: 10.7270/Q2B27Z0N
More data for this
Ligand-Target Pair