Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(1A)/D(1B)/D(2)/D(3)/D(4) dopamine receptor' and Ligand = 'BDBM50228777'   

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(1A)/D(1B)/D(2)/D(3)/D(4) dopamine receptor (Homo sapiens (Human))	BDBM50228777 (CHEMBL80127) Show SMILES [H][C@@]1(CNC(=O)c2c(O)c(Cl)cc(Cl)c2OC)CCCN1CCC Show InChI InChI=1S/C16H22Cl2N2O3/c1-3-6-20-7-4-5-10(20)9-19-16(22)13-14(21)11(17)8-12(18)15(13)23-2/h8,10,21H,3-7,9H2,1-2H3,(H,19,22)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description In vitro inhibition of [3H]spiperone binding to Dopamine receptor D2 in Macaca nemestrina striatal membranes				J Med Chem 33: 2430-7 (1990) BindingDB Entry DOI: 10.7270/Q23J3BXF
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