Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(4) dopamine receptor' and Ligand = 'BDBM50077002'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50077002 (3-[4-(5-Methyl-4-phenyl-pyrazol-1-yl)-piperidin-1-...) Show SMILES Cc1c(cnn1C1CCN(Cc2cccc(c2)C#N)CC1)-c1ccccc1 Show InChI InChI=1S/C23H24N4/c1-18-23(21-8-3-2-4-9-21)16-25-27(18)22-10-12-26(13-11-22)17-20-7-5-6-19(14-20)15-24/h2-9,14,16,22H,10-13,17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	5.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]-spiperone from human Dopamine receptor D4 expressed in HEK-293 cells				Bioorg Med Chem Lett 9: 1285-90 (1999) BindingDB Entry DOI: 10.7270/Q2C53K1C
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