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BDBM50022680 CHEMBL3298451

SMILES: OC(=O)c1cc2cnccc2n1CCOc1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=YYRGWTNWICCJEY-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50022680   
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
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM50022680
PNG
(CHEMBL3298451)
Show SMILES OC(=O)c1cc2cnccc2n1CCOc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C17H13F3N2O4/c18-17(19,20)26-13-3-1-12(2-4-13)25-8-7-22-14-5-6-21-10-11(14)9-15(22)16(23)24/h1-6,9-10H,7-8H2,(H,23,24)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.58E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human TrkA expressed in human U2OS cells assessed as inhibition of NGF-induced maximum response after 1 hr by beta-galactosidase assay


J Med Chem 57: 5800-16 (2014)


Article DOI: 10.1021/jm5006429
BindingDB Entry DOI: 10.7270/Q2BV7J69
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM50022680
PNG
(CHEMBL3298451)
Show SMILES OC(=O)c1cc2cnccc2n1CCOc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C17H13F3N2O4/c18-17(19,20)26-13-3-1-12(2-4-13)25-8-7-22-14-5-6-21-10-11(14)9-15(22)16(23)24/h1-6,9-10H,7-8H2,(H,23,24)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.23E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of phsophorylated TrkA (unknown origin) assessed as inhibition of fluorescently-labelled substrate phosphorylation by CALIPER enzymatic as...


J Med Chem 57: 5800-16 (2014)


Article DOI: 10.1021/jm5006429
BindingDB Entry DOI: 10.7270/Q2BV7J69
More data for this
Ligand-Target Pair