BindingDB logo
myBDB logout

BDBM50494254 CHEMBL3087487

SMILES: COc1cccc2c1COc1cc(Nc3ccc(F)cc3N)ccc1C2=O

InChI Key: InChIKey=DSOQXAWKLQXARN-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50494254   
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
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50494254
PNG
(CHEMBL3087487)
Show SMILES COc1cccc2c1COc1cc(Nc3ccc(F)cc3N)ccc1C2=O
Show InChI InChI=1S/C21H17FN2O3/c1-26-19-4-2-3-14-16(19)11-27-20-10-13(6-7-15(20)21(14)25)24-18-8-5-12(22)9-17(18)23/h2-10,24H,11,23H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 87n/an/an/an/an/an/a



Eberhard-Karls-University T£bingen

Curated by ChEMBL


Assay Description
Competitive inhibition of p38alpha MAP kinase (unknown origin) in presence of 100 uM ATP


J Med Chem 56: 8561-78 (2013)


Article DOI: 10.1021/jm401276h
BindingDB Entry DOI: 10.7270/Q2Q81H2C
More data for this
Ligand-Target Pair