BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2D6' and Ligand = 'BDBM50047018'   
Target/Host
(Institution)		LigandTarget/Host
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
Cytochrome P450 2D6


(Homo sapiens (Human))		BDBM50047018
PNG
(8-Methyl-5,6,7,7a,8,9,11a,12,12a,13-decahydro-6a,9...)
Show SMILES COC(=O)C1C=NC(C)C2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |c:5|
Show InChI InChI=1S/C21H25N3O2/c1-12-17-11-24-8-7-14-13-5-3-4-6-18(13)23-20(14)19(24)9-15(17)16(10-22-12)21(25)26-2/h3-6,10,12,15-17,19,23H,7-9,11H2,1-2H3/t12?,15-,16?,17?,19+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 2.90E+3n/an/an/an/an/an/an/an/a



Institut f£r Toxikologie

Curated by ChEMBL


Assay Description
Inhibitory effect on Bufuralol 1'-hydroxylation by human liver microsomes (Ki = apparent inhibition constant)

J Med Chem 36: 1136-45 (1993)


BindingDB Entry DOI: 10.7270/Q2GM87X6
More data for this
Ligand-Target Pair