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SMILES: CCCCCCCCS(=O)(=O)Nc1cc(Sc2nnc[nH]2)c(O)c2ccccc12

InChI Key: InChIKey=YXFRXGMTQARJCO-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50420792   
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


(Homo sapiens (Human))		BDBM50420792
PNG
(CHEMBL2088024)
Show SMILES CCCCCCCCS(=O)(=O)Nc1cc(Sc2nnc[nH]2)c(O)c2ccccc12
Show InChI InChI=1S/C20H26N4O3S2/c1-2-3-4-5-6-9-12-29(26,27)24-17-13-18(28-20-21-14-22-23-20)19(25)16-11-8-7-10-15(16)17/h7-8,10-11,13-14,24-25H,2-6,9,12H2,1H3,(H,21,22,23)
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Article
PubMed
n/an/a 1.66E+3n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibition of human 6x-His tagged wild type BRAF expressed in Sf9 cells by ELISA based kinase assay

J Med Chem 55: 5220-30 (2012)


Article DOI: 10.1021/jm3004416
BindingDB Entry DOI: 10.7270/Q2ZC8451
More data for this
Ligand-Target Pair