Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50031296'   

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(2) dopamine receptor (Homo sapiens (Human))	BDBM50031296 (7-[3-(4-Benzhydryl-piperidin-1-yl)-propyl]-1,3-dim...) Show SMILES Cn1c2ncn(CCCN3CCC(CC3)C(c3ccccc3)c3ccccc3)c2c(=O)n(C)c1=O Show InChI InChI=1S/C28H33N5O2/c1-30-26-25(27(34)31(2)28(30)35)33(20-29-26)17-9-16-32-18-14-23(15-19-32)24(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-8,10-13,20,23-24H,9,14-19H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description Compound is evaluated for in vitro receptor binding affinity against Dopamine receptor D2				J Med Chem 38: 4026-32 (1995) BindingDB Entry DOI: 10.7270/Q2MK6DJG
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