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BDBM50241069 CHEMBL4094105

SMILES: NC(=O)c1ccc2CCc3cc(Nc4cc(NC(=O)C5CC5)c(F)cc4F)ccc3C(=O)c2c1

InChI Key: InChIKey=DJWZGMHVBCBCRN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50241069   
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))
BDBM50241069
PNG
(CHEMBL4094105)
Show SMILES NC(=O)c1ccc2CCc3cc(Nc4cc(NC(=O)C5CC5)c(F)cc4F)ccc3C(=O)c2c1
Show InChI InChI=1S/C26H21F2N3O3/c27-20-11-21(28)23(31-26(34)14-3-4-14)12-22(20)30-17-7-8-18-15(9-17)5-1-13-2-6-16(25(29)33)10-19(13)24(18)32/h2,6-12,14,30H,1,3-5H2,(H2,29,33)(H,31,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.900n/an/an/an/an/an/a



Eberhard-Karls-Universitaet Tuebingen

Curated by ChEMBL


Assay Description
Inhibition of P38 alpha MAPK (unknown origin) by ELISA


J Med Chem 60: 8027-8054 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00745
BindingDB Entry DOI: 10.7270/Q2RV0QVZ
More data for this
Ligand-Target Pair