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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase B-raf' and Ligand = 'BDBM50176321'   
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
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))
BDBM50176321
PNG
(5-(5-(2-aminopyrimidin-4-yl)-2-phenyl-1H-imidazol-...)
Show SMILES Nc1nccc(n1)-c1nc([nH]c1-c1ccc(Cl)c(O)c1)-c1ccccc1
Show InChI InChI=1S/C19H14ClN5O/c20-13-7-6-12(10-15(13)26)16-17(14-8-9-22-19(21)23-14)25-18(24-16)11-4-2-1-3-5-11/h1-10,26H,(H,24,25)(H2,21,22,23)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/a 5.70n/an/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity at bRaf kinase in fluorescent ligand displacement assay


Bioorg Med Chem Lett 16: 378-81 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.072
BindingDB Entry DOI: 10.7270/Q2Z038Z9
More data for this
Ligand-Target Pair