Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50382301'   

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 (Rattus norvegicus (rat))	BDBM50382301 (CHEMBL2024515) Show SMILES CS(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |r,wU:5.4,wD:8.8,(-1.04,-12.4,;.29,-11.63,;1.06,-10.3,;-.48,-10.29,;1.62,-12.4,;2.96,-11.63,;2.96,-10.09,;4.28,-9.31,;5.61,-10.09,;6.95,-9.32,;8.28,-10.1,;9.62,-9.33,;10.94,-10.11,;12.27,-9.35,;12.29,-7.81,;10.96,-7.03,;9.61,-7.79,;13.63,-7.05,;14.97,-7.79,;16.3,-6.99,;16.26,-5.45,;14.92,-4.72,;14.89,-3.18,;13.6,-5.51,;12.25,-4.76,;5.61,-11.63,;4.28,-12.39,)| Show InChI InChI=1S/C19H29Cl2N3O2S/c1-27(25,26)22-16-7-5-15(6-8-16)9-10-23-11-13-24(14-12-23)18-4-2-3-17(20)19(18)21/h2-4,15-16,22H,5-14H2,1H3/t15-,16-	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from dopamine D2 receptor in rat striatal membranes				Bioorg Med Chem Lett 22: 3437-40 (2012) Article DOI: 10.1016/j.bmcl.2012.03.104 BindingDB Entry DOI: 10.7270/Q2ZW1MZN
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