Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50382303'   

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))	BDBM50382303 (CHEMBL2024519) Show SMILES CCN(CC)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |r,wU:8.7,wD:11.11,(-.58,-8.63,;.75,-7.86,;.75,-6.32,;-.58,-5.55,;-1.92,-6.32,;2.09,-5.55,;2.09,-4.01,;3.42,-6.33,;4.75,-5.55,;4.75,-4.01,;6.08,-3.24,;7.41,-4.01,;8.75,-3.25,;10.08,-4.02,;11.41,-3.26,;12.74,-4.03,;14.07,-3.27,;14.08,-1.73,;12.75,-.96,;11.41,-1.72,;15.42,-.97,;16.73,-1.79,;18.09,-1.06,;18.14,.48,;16.84,1.29,;16.89,2.83,;15.47,.56,;14.17,1.38,;7.41,-5.55,;6.08,-6.32,)| Show InChI InChI=1S/C23H36Cl2N4O/c1-3-28(4-2)23(30)26-19-10-8-18(9-11-19)12-13-27-14-16-29(17-15-27)21-7-5-6-20(24)22(21)25/h5-7,18-19H,3-4,8-17H2,1-2H3,(H,26,30)/t18-,19-	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	42.9	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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