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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(4) dopamine receptor' and Ligand = 'BDBM50267795'   
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(4) dopamine receptor


(Homo sapiens (Human))		BDBM50267795
PNG
(CHEMBL4096858)
Show SMILES CC(C)(C)c1nc(cc(n1)C(F)(F)F)N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Show InChI InChI=1S/C26H32F3N5OS/c1-25(2,3)24-31-21(26(27,28)29)17-22(32-24)34-14-12-33(13-15-34)11-7-6-10-30-23(35)20-16-18-8-4-5-9-19(18)36-20/h4-5,8-9,16-17H,6-7,10-15H2,1-3H3,(H,30,35)
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PC cid
PC sid
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Department of Medicinal Chemistry, Emil Fischer Center, Friedrich-Alexander University, Schuhstra?e 19, D-91052 Erlangen, Germany.

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D4 receptor expressed in CHO cell membranes

Bioorg Med Chem 25: 3491-3499 (2017)


Article DOI: 10.1016/j.bmc.2017.04.036
BindingDB Entry DOI: 10.7270/Q2KW5JH3
More data for this
Ligand-Target Pair