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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50533798'   
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(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50533798
PNG
(CHEMBL4593758)
Show SMILES CCCN(C\C=C\c1ccc(O)c(OC)c1)C1CCc2nc(N)sc2C1
Show InChI InChI=1S/C20H27N3O2S/c1-3-10-23(15-7-8-16-19(13-15)26-20(21)22-16)11-4-5-14-6-9-17(24)18(12-14)25-2/h4-6,9,12,15,24H,3,7-8,10-11,13H2,1-2H3,(H2,21,22)/b5-4+
PDB

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PC cid
PC sid
UniChem
Article
PubMed
 4.63E+3n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from rat D2L dopamine receptor expressed in HEK293 cell membranes after 1 hr

Bioorg Med Chem 24: 5088-5102 (2016)


Article DOI: 10.1016/j.bmc.2016.08.021
BindingDB Entry DOI: 10.7270/Q2B85CNF
More data for this
Ligand-Target Pair