Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM476862'   

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))	BDBM476862 (US10870660, Compound II-029 | US11345716, Compound...) Show SMILES Cc1ncc(CC(=O)N[C@H]2CC[C@H](CCN3CCc4nc(OCC(C)(F)F)sc4CC3)CC2)o1 |r,wU:12.12,wD:9.8,(13.21,2.3,;11.67,2.3,;10.77,1.05,;9.3,1.53,;9.3,3.07,;7.97,3.84,;6.63,3.07,;6.63,1.53,;5.3,3.84,;3.97,3.07,;2.63,3.84,;1.3,3.07,;1.3,1.53,;-.03,.76,;-1.37,1.53,;-2.7,.76,;-3.91,1.72,;-5.41,1.38,;-6.08,-.01,;-7.6,-.22,;-7.88,-1.73,;-9.21,-2.5,;-10.54,-1.73,;-11.88,-2.5,;-13.21,-1.73,;-12.65,-3.84,;-11.11,-3.84,;-6.52,-2.46,;-5.41,-1.4,;-3.91,-1.74,;-2.7,-.78,;2.63,.76,;3.97,1.53,;10.77,3.54,)| Show InChI InChI=1S/C24H34F2N4O3S/c1-16-27-14-19(33-16)13-22(31)28-18-5-3-17(4-6-18)7-10-30-11-8-20-21(9-12-30)34-23(29-20)32-15-24(2,25)26/h14,17-18H,3-13,15H2,1-2H3,(H,28,31)/t17-,18-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.120	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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