Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(1A) dopamine receptor' and Ligand = 'BDBM50152839'   

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) dopamine receptor (Homo sapiens (Human))	BDBM50152839 (CHEMBL3780438) Show SMILES COc1cc(CCN(C)Cc2cccc(O)c2OC)ccc1O Show InChI InChI=1S/C18H23NO4/c1-19(12-14-5-4-6-16(21)18(14)23-3)10-9-13-7-8-15(20)17(11-13)22-2/h4-8,11,20-21H,9-10,12H2,1-3H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.11E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
City University of New York Curated by ChEMBL					Assay Description Displacement of [3H]SCH2390 from human dopamine D1 receptor by PDSP assay				Bioorg Med Chem 24: 2060-71 (2016) Article DOI: 10.1016/j.bmc.2016.03.037 BindingDB Entry DOI: 10.7270/Q2SX6G3G
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