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BDBM50265838 3-(3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-yl)phenol::3-[3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-yl]phenol::CHEMBL462712

SMILES: CN1CCN(CC1)c1cnc2cc(cc(-c3cccc(O)c3)c2n1)C(F)(F)F

InChI Key: InChIKey=QNCYYRHIUFGGJX-UHFFFAOYSA-N

Data: 2 IC50

PDB links: 1 PDB ID matches this monomer.

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 = 50265838   
Target
(Institution)
LigandTarget
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
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50265838
PNG
(3-(3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)q...)
Show SMILES CN1CCN(CC1)c1cnc2cc(cc(-c3cccc(O)c3)c2n1)C(F)(F)F
Show InChI InChI=1S/C20H19F3N4O/c1-26-5-7-27(8-6-26)18-12-24-17-11-14(20(21,22)23)10-16(19(17)25-18)13-3-2-4-15(28)9-13/h2-4,9-12,28H,5-8H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
PDB
Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of human c-MET


Eur J Med Chem 46: 3675-80 (2011)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50265838
PNG
(3-(3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)q...)
Show SMILES CN1CCN(CC1)c1cnc2cc(cc(-c3cccc(O)c3)c2n1)C(F)(F)F
Show InChI InChI=1S/C20H19F3N4O/c1-26-5-7-27(8-6-26)18-12-24-17-11-14(20(21,22)23)10-16(19(17)25-18)13-3-2-4-15(28)9-13/h2-4,9-12,28H,5-8H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
PDB
Article
PubMed
n/an/a 900n/an/an/an/an/an/a



UCB Celltech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant his-tagged c-Met by TR-FRET assay


Bioorg Med Chem Lett 19: 397-400 (2008)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)