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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase Yes' and Ligand = 'BDBM50050848'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50050848
PNG
(CHEMBL3318026)
Show SMILES COc1cc(ccc1O)-c1cnc2ccc(NC(=O)NC(C)(C)C)nc2c1
Show InChI InChI=1S/C20H22N4O3/c1-20(2,3)24-19(26)23-18-8-6-14-15(22-18)9-13(11-21-14)12-5-7-16(25)17(10-12)27-4/h5-11,25H,1-4H3,(H2,22,23,24,26)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 4.29E+4n/an/an/an/an/an/a



Universit£ de Nantes

Curated by ChEMBL


Assay Description
Inhibition of YES (unknown origin)


Bioorg Med Chem Lett 24: 3748-52 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.078
BindingDB Entry DOI: 10.7270/Q270832Z
More data for this
Ligand-Target Pair