Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM359993'   

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
Apelin receptor (Homo sapiens (Human))	BDBM359993 ((1R,2S)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-...) Show SMILES COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(F)cc2Br)n1-c1c(OC)cccc1OC |r,wU:22.23,wD:24.25,(-19.42,-10.09,;-19.74,-8.58,;-18.59,-7.55,;-18.91,-6.04,;-17.77,-5.01,;-16.3,-5.49,;-15.98,-6.99,;-17.13,-8.02,;-14.52,-7.47,;-14.04,-8.94,;-12.5,-8.94,;-12.03,-7.47,;-10.56,-6.99,;-10.24,-5.49,;-8.78,-5.01,;-8.46,-3.51,;-6.99,-3.03,;-9.6,-2.48,;-8.14,-2,;-9.42,-8.02,;-10.51,-9.11,;-9.02,-9.51,;-8.08,-7.25,;-8.08,-5.71,;-6.75,-8.02,;-6.75,-9.56,;-5.42,-7.25,;-5.42,-5.71,;-4.08,-4.94,;-2.75,-5.71,;-1.41,-4.94,;-2.75,-7.25,;-4.08,-8.02,;-4.08,-9.56,;-13.27,-6.57,;-13.27,-5.03,;-14.61,-4.26,;-15.94,-5.03,;-17.27,-4.26,;-14.61,-2.72,;-13.27,-1.95,;-11.94,-2.72,;-11.94,-4.26,;-10.6,-5.03,;-9.27,-4.26,)| Show InChI InChI=1S/C30H37BrFN5O6SSi/c1-19(28(38)21-15-14-20(32)18-22(21)31)44(39,40)36(16-17-45(5,6)7)30-35-34-29(23-10-8-13-26(33-23)43-4)37(30)27-24(41-2)11-9-12-25(27)42-3/h8-15,18-19,28,38H,16-17H2,1-7H3/t19-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.10	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10221162 (2019) BindingDB Entry DOI: 10.7270/Q2ZK5JXS
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