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BDBM103673 US8563553, 98

SMILES: COC(=O)N[C@@H](C)CNc1nccc(n1)-c1nc([nH]c1-c1cc(Cl)cc(NS(=O)(=O)c2cccc(F)c2)c1F)C1CC1

InChI Key: InChIKey=FAGJFBOKLUFLLZ-AWEZNQCLSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 103673   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))
BDBM103673
PNG
(US8563553, 98)
Show SMILES COC(=O)N[C@@H](C)CNc1nccc(n1)-c1nc([nH]c1-c1cc(Cl)cc(NS(=O)(=O)c2cccc(F)c2)c1F)C1CC1 |r|
Show InChI InChI=1S/C27H26ClF2N7O4S/c1-14(33-27(38)41-2)13-32-26-31-9-8-20(34-26)24-23(35-25(36-24)15-6-7-15)19-10-16(28)11-21(22(19)30)37-42(39,40)18-5-3-4-17(29)12-18/h3-5,8-12,14-15,37H,6-7,13H2,1-2H3,(H,33,38)(H,35,36)(H,31,32,34)/t14-/m0/s1
PDB

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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 0.330n/an/an/an/a7.5n/a



Novartis AG; IRM LLC

US Patent


Assay Description
Raf/Mek amplified luminescence proximity homogeneous assay.


US Patent US8563553 (2013)


BindingDB Entry DOI: 10.7270/Q2ZP44R7
More data for this
Ligand-Target Pair