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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 = 'BDBM300143'   
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))
BDBM300143
PNG
(US9593100, Compound 24)
Show SMILES COC(=O)N[C@@H](C)CNc1nccc(n1)-c1cn(nc1-c1cc(F)cc(NS(=O)(=O)C2CC2)c1F)C(C)C |r|
Show InChI InChI=1S/C24H29F2N7O4S/c1-13(2)33-12-18(19-7-8-27-23(30-19)28-11-14(3)29-24(34)37-4)22(31-33)17-9-15(25)10-20(21(17)26)32-38(35,36)16-5-6-16/h7-10,12-14,16,32H,5-6,11H2,1-4H3,(H,29,34)(H,27,28,30)/t14-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 23n/an/an/an/an/an/a



Array BioPharma, Inc.

US Patent


Assay Description
B-Raf (V600E; 4 pM) and biotinylated Mek (kinase dead; 10 nM) were combined at 2× final concentrations in assay buffer (50 mM Tris, pH 7.5, 15 mM MgC...


US Patent US9593100 (2017)


BindingDB Entry DOI: 10.7270/Q2765HDB
More data for this
Ligand-Target Pair