Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM476843'   

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(3) dopamine receptor (Homo sapiens (Human))	BDBM476843 (US10870660, Compound III-630 | US11345716, Compoun...) Show SMILES Cn1ccc2c(cccc2c1=O)C(=O)N[C@H]1CC[C@H](CCN2CCc3sc(OCC(C)(F)F)nc3C2)CC1 |r,wU:18.20,wD:15.16,(13.11,-1.54,;11.78,-.77,;10.45,-1.54,;9.11,-.77,;9.11,.77,;7.78,1.54,;7.78,3.08,;9.11,3.85,;10.45,3.08,;10.45,1.54,;11.78,.77,;13.11,1.54,;6.44,.77,;6.44,-.77,;5.11,1.54,;3.78,.77,;2.44,1.54,;1.11,.77,;1.11,-.77,;-.22,-1.54,;-1.56,-.77,;-2.89,-1.54,;-2.89,-3.08,;-4.23,-3.85,;-5.56,-3.08,;-7.02,-3.56,;-7.93,-2.31,;-9.47,-2.31,;-10.24,-.98,;-11.78,-.98,;-12.55,.36,;-11.78,-2.52,;-13.11,-1.75,;-7.02,-1.06,;-5.56,-1.54,;-4.23,-.77,;2.44,-1.54,;3.78,-.77,)| Show InChI InChI=1S/C28H34F2N4O3S/c1-28(29,30)17-37-27-32-23-16-34(15-12-24(23)38-27)14-10-18-6-8-19(9-7-18)31-25(35)21-4-3-5-22-20(21)11-13-33(2)26(22)36/h3-5,11,13,18-19H,6-10,12,14-17H2,1-2H3,(H,31,35)/t18-,19-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SHIONOGI & CO., LTD. US Patent					Assay Description 225 nL of the solutions of the non-specific ligand or the compounds of the present invention at each concentration (in case of vehicle, final concent...				US Patent US10870660 (2020) BindingDB Entry DOI: 10.7270/Q2M61PBD
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