Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ephrin type-B receptor 4' and Ligand = 'BDBM50299224'   

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
Ephrin type-B receptor 4 (Homo sapiens (Human))	BDBM50299224 (8-(2-Methoxyphenyl)-1-methyl-7-(2'-methyl-3'-hydro...) Show SMILES COc1ccccc1-n1c(cn2c1nc1n(C)c(=O)[nH]c(=O)c21)-c1cccc(O)c1C |(34.18,-29.88,;34.18,-28.34,;35.52,-27.58,;36.84,-28.34,;38.17,-27.58,;38.17,-26.03,;36.84,-25.27,;35.52,-26.04,;34.19,-25.27,;34.2,-23.73,;32.73,-23.25,;31.82,-24.49,;32.72,-25.74,;31.82,-26.99,;30.35,-26.51,;29.03,-27.27,;29.02,-28.81,;27.7,-26.51,;26.36,-27.28,;27.7,-24.97,;29.03,-24.19,;29.03,-22.65,;30.35,-24.97,;35.53,-22.95,;36.87,-23.72,;38.19,-22.94,;38.19,-21.4,;36.84,-20.64,;36.82,-19.1,;35.52,-21.42,;34.18,-20.66,)| Show InChI InChI=1S/C22H19N5O4/c1-12-13(7-6-9-16(12)28)15-11-26-18-19(25(2)22(30)24-20(18)29)23-21(26)27(15)14-8-4-5-10-17(14)31-3/h4-11,28H,1-3H3,(H,24,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Zurich Curated by ChEMBL					Assay Description Inhibition of EphB4 assessed as blockade of synthetic substrate phosphorylation by FRET assay				J Med Chem 52: 6433-46 (2009) Article DOI: 10.1021/jm9009444 BindingDB Entry DOI: 10.7270/Q2BZ663G
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