Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase Mer' and Ligand = 'BDBM50469347'   

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
Tyrosine-protein kinase Mer (Homo sapiens (Human))	BDBM50469347 (CHEMBL4287078) Show SMILES CCC(C)CNc1ncc2c(cn([C@H]3CC[C@H](O)CC3)c2n1)-c1ccc(CN2CCN(C)CC2)cc1 |r,wU:13.12,wD:16.16,(15.26,-22.05,;16.59,-21.28,;17.93,-22.05,;17.93,-23.59,;19.26,-21.28,;20.59,-22.05,;21.93,-21.28,;21.93,-19.74,;23.26,-18.97,;24.6,-19.73,;26.07,-19.25,;26.98,-20.51,;26.07,-21.76,;26.82,-23.11,;28.36,-23.13,;29.1,-24.48,;28.3,-25.8,;29.04,-27.15,;26.76,-25.77,;26.02,-24.42,;24.6,-21.28,;23.26,-22.06,;26.78,-17.89,;28.32,-17.83,;29.04,-16.47,;28.21,-15.17,;28.92,-13.8,;30.46,-13.73,;31.29,-15.04,;32.82,-14.98,;33.54,-13.61,;35.07,-13.55,;32.71,-12.31,;31.17,-12.37,;26.66,-15.24,;25.96,-16.6,)| Show InChI InChI=1S/C29H42N6O/c1-4-21(2)17-30-29-31-18-26-27(20-35(28(26)32-29)24-9-11-25(36)12-10-24)23-7-5-22(6-8-23)19-34-15-13-33(3)14-16-34/h5-8,18,20-21,24-25,36H,4,9-17,19H2,1-3H3,(H,30,31,32)/t21?,24-,25-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a	n/a
UNC Eshelman School of Pharmacy Curated by ChEMBL					Assay Description Inhibition of MERTK (unknown origin) using 5'-FAM-EFPIYDFLPAKKK-CONH2 as substrate after 180 mins by MCE assay				J Med Chem 61: 10242-10254 (2018) Article DOI: 10.1021/acs.jmedchem.8b01229 BindingDB Entry DOI: 10.7270/Q2K076ZK
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