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 = 'BDBM50224267'   

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...)	BDBM50224267 (CHEMBL418221) Show SMILES CSc1c(Cl)nc(NCc2ccc(cc2)C(C)(C)C)nc1N1CCN(C)CC1 Show InChI InChI=1S/C21H30ClN5S/c1-21(2,3)16-8-6-15(7-9-16)14-23-20-24-18(22)17(28-5)19(25-20)27-12-10-26(4)11-13-27/h6-9H,10-14H2,1-5H3,(H,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	385	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro ability to displace [3H]spiroperidol from rat dopamine receptor				J Med Chem 25: 1459-65 (1982) BindingDB Entry DOI: 10.7270/Q2SQ92KV
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