Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50021806'   

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))	BDBM50021806 (CHEMBL3299098) Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(=O)NCCN1CCC(O)(CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C23H27ClN4O2S/c1-14-13-15(2)27-22-18(14)19(25)20(31-22)21(29)26-9-12-28-10-7-23(30,8-11-28)16-3-5-17(24)6-4-16/h3-6,13,30H,7-12,25H2,1-2H3,(H,26,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	910	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human D2L receptor expressed in FlpIn CHO cell membrane after 3 hrs by liquid scintillation counting analysis				J Med Chem 57: 4924-39 (2014) Article DOI: 10.1021/jm500457x BindingDB Entry DOI: 10.7270/Q29Z96FS
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