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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM50072822'   
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
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50072822
PNG
(7-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Show SMILES OCc1coc2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc2c1=O
Show InChI InChI=1S/C25H25FN2O5/c26-18-2-4-20-23(12-18)33-27-24(20)16-6-9-28(10-7-16)8-1-11-31-19-3-5-21-22(13-19)32-15-17(14-29)25(21)30/h2-5,12-13,15-16,29H,1,6-11,14H2
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Article
PubMed
 5.40n/an/an/an/an/an/an/an/a



Centro de Investigación Grupo Ferrer

Curated by ChEMBL


Assay Description
Binding affinity measured at the Dopamine receptor D3 by the inhibition of [3H]-YM-09151-2 binding to human recombinant CCL 1.3 cells using unlabeled...

J Med Chem 41: 5402-9 (1999)


Article DOI: 10.1021/jm9810396
BindingDB Entry DOI: 10.7270/Q2QC02N8
More data for this
Ligand-Target Pair