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 = 'BDBM50225784'   

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 (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50225784 (CHEMBL542375) Show SMILES Cl.Fc1ccc(cc1)-n1c2CCN(CCCCCCNC(=O)c3ccccc3)Cc2c2cc(F)ccc12 Show InChI InChI=1S/C30H31F2N3O/c31-23-10-13-25(14-11-23)35-28-15-12-24(32)20-26(28)27-21-34(19-16-29(27)35)18-7-2-1-6-17-33-30(36)22-8-4-3-5-9-22/h3-5,8-15,20H,1-2,6-7,16-19,21H2,(H,33,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	8.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]spiroperidol (0.5 nM) binding to dopamine receptor from rat striatal membrane.				J Med Chem 29: 8-19 (1986) BindingDB Entry DOI: 10.7270/Q2NP26N5
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