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BDBM104874 US8569316, III-41

SMILES: COCCN1CCC(C1)c1ccc2ncnc(Nc3cc(ccc3C)C(=O)Nc3cc(cc(NS(C)(=O)=O)c3OC)C(C)(C)C)c2n1

InChI Key: InChIKey=KEQFQZOUNFMJHA-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 104874   
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
B-RAF V600E


(Homo sapiens (Human))
BDBM104874
PNG
(US8569316, III-41)
Show SMILES COCCN1CCC(C1)c1ccc2ncnc(Nc3cc(ccc3C)C(=O)Nc3cc(cc(NS(C)(=O)=O)c3OC)C(C)(C)C)c2n1
Show InChI InChI=1/C34H43N7O5S/c1-21-8-9-22(33(42)39-28-17-24(34(2,3)4)18-29(31(28)46-6)40-47(7,43)44)16-27(21)38-32-30-26(35-20-36-32)11-10-25(37-30)23-12-13-41(19-23)14-15-45-5/h8-11,16-18,20,23,40H,12-15,19H2,1-7H3,(H,39,42)(H,35,36,38)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 315n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro kinase assay.


US Patent US8569316 (2013)


BindingDB Entry DOI: 10.7270/Q29W0D44
More data for this
Ligand-Target Pair