Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50198296'   

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))	BDBM50198296 (1-((1H-indol-3-yl)methyl)-4-(4-(methylthio)phenyl)...) Show SMILES CSc1ccc(cc1)C1(O)CCN(Cc2c[nH]c3ccccc23)CC1 Show InChI InChI=1S/C21H24N2OS/c1-25-18-8-6-17(7-9-18)21(24)10-12-23(13-11-21)15-16-14-22-20-5-3-2-4-19(16)20/h2-9,14,22,24H,10-13,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [125I]IABN from human dopamine D2L receptor expressed in HEK293 cells				Bioorg Med Chem Lett 17: 745-9 (2007) Article DOI: 10.1016/j.bmcl.2006.10.076 BindingDB Entry DOI: 10.7270/Q2N879FG
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