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BDBM50198809 4-(6-methyl-7-(2-(trifluoromethyl)phenyl)benzo[e][1,2,4]triazin-3-ylamino)-N-(2-(pyrrolidin-1-yl)ethyl)benzenesulfonamide::CHEMBL231338::US8481536, 447

SMILES: Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C(F)(F)F

InChI Key: InChIKey=FDDHJANHSBOLPP-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50198809   
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
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50198809
PNG
(4-(6-methyl-7-(2-(trifluoromethyl)phenyl)benzo[e][...)
Show SMILES Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C27H27F3N6O2S/c1-18-16-24-25(17-22(18)21-6-2-3-7-23(21)27(28,29)30)34-35-26(33-24)32-19-8-10-20(11-9-19)39(37,38)31-12-15-36-13-4-5-14-36/h2-3,6-11,16-17,31H,4-5,12-15H2,1H3,(H,32,33,35)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 67n/an/an/an/an/an/a



TargeGen, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


Bioorg Med Chem Lett 17: 602-8 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.006
BindingDB Entry DOI: 10.7270/Q29024MW
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50198809
PNG
(4-(6-methyl-7-(2-(trifluoromethyl)phenyl)benzo[e][...)
Show SMILES Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C27H27F3N6O2S/c1-18-16-24-25(17-22(18)21-6-2-3-7-23(21)27(28,29)30)34-35-26(33-24)32-19-8-10-20(11-9-19)39(37,38)31-12-15-36-13-4-5-14-36/h2-3,6-11,16-17,31H,4-5,12-15H2,1H3,(H,32,33,35)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

US Patent
n/an/a 66.5n/an/an/an/an/a25



TargeGen, Inc.

US Patent


Assay Description
Testing of inhibition of kinases in vitro using luciferase-based assay from KinaseGlo, Promega Corp.


US Patent US8481536 (2013)


BindingDB Entry DOI: 10.7270/Q2GB22PZ
More data for this
Ligand-Target Pair