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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2D6' and Ligand = 'BDBM325598'   
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))		BDBM325598
PNG
(3-[5-(1-Cyclopropylmethyl-piperidin-4-yl)-[1,3,4]o...)
Show SMILES CC(C)n1nc(-c2nnc(o2)C2CCN(CC3CC3)CC2)c2ccccc12
Show InChI InChI=1S/C21H27N5O/c1-14(2)26-18-6-4-3-5-17(18)19(24-26)21-23-22-20(27-21)16-9-11-25(12-10-16)13-15-7-8-15/h3-6,14-16H,7-13H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 3.60E+4n/an/an/an/an/an/a


TBA

Assay Description
The compound was tested for beta-adrenergic activity against Beta-1 adrenergic receptor from guinea pig left atria

Citation and Details
More data for this
Ligand-Target Pair