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SMILES: Fc1ccc(NS(=O)(=O)c2cccc3CCOc23)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12

InChI Key: InChIKey=HQLSNMHUQKMLRG-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 197707   
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))
BDBM197707
PNG
(US9216981, 36)
Show SMILES Fc1ccc(NS(=O)(=O)c2cccc3CCOc23)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C24H17F2N7O3S/c25-15-6-7-16(33-37(34,35)17-5-1-3-13-8-10-36-22(13)17)18(26)20(15)32-23-14(4-2-9-27-23)19-21-24(30-11-28-19)31-12-29-21/h1-7,9,11-12,33H,8,10H2,(H,27,32)(H,28,29,30,31)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 8.37E+3n/an/an/a37



Medpacto, Inc.

US Patent


Assay Description
To check the B-Raf cell activity inhibitory capability of the compounds of the present invention, the following experiments were conducted in A375P...


US Patent US9216981 (2015)


BindingDB Entry DOI: 10.7270/Q2BC3XCR
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))
BDBM197707
PNG
(US9216981, 36)
Show SMILES Fc1ccc(NS(=O)(=O)c2cccc3CCOc23)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C24H17F2N7O3S/c25-15-6-7-16(33-37(34,35)17-5-1-3-13-8-10-36-22(13)17)18(26)20(15)32-23-14(4-2-9-27-23)19-21-24(30-11-28-19)31-12-29-21/h1-7,9,11-12,33H,8,10H2,(H,27,32)(H,28,29,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.02E+3n/an/an/an/a7.230



Medpacto, Inc.

US Patent


Assay Description
To check the B-Raf kinase inhibitory activity of the compounds of the present invention, the following experiments were conducted.(1) Serial Signalin...


US Patent US9216981 (2015)


BindingDB Entry DOI: 10.7270/Q2BC3XCR
More data for this
Ligand-Target Pair