Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50212345'   

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))	BDBM50212345 (CHEMBL70866) Show SMILES COc1ccc(OC)c(c1)N1CCN(CCCCNC(=O)c2ccc(Br)cc2)CC1 Show InChI InChI=1S/C23H30BrN3O3/c1-29-20-9-10-22(30-2)21(17-20)27-15-13-26(14-16-27)12-4-3-11-25-23(28)18-5-7-19(24)8-6-18/h5-10,17H,3-4,11-16H2,1-2H3,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity towards mouse LtK- cells transfected with human D2 receptor using [3H]spiperone				Citation and Details BindingDB Entry DOI: 10.7270/Q24B33GZ
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