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BDBM50516387 CHEMBL4515859

SMILES: Fc1cccc(F)c1C(=O)c1c[nH]c(c1)C(=O)Nc1cccnc1

InChI Key: InChIKey=HUICPWGBGIIDPB-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50516387   
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))
BDBM50516387
PNG
(CHEMBL4515859)
Show SMILES Fc1cccc(F)c1C(=O)c1c[nH]c(c1)C(=O)Nc1cccnc1
Show InChI InChI=1S/C17H11F2N3O2/c18-12-4-1-5-13(19)15(12)16(23)10-7-14(21-8-10)17(24)22-11-3-2-6-20-9-11/h1-9,21H,(H,22,24)
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 3.50E+4n/an/an/an/an/an/a



Newcastle University

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal GST-tagged full length human p38alpha expressed in Escherichia coli cells assessed as substrate phosphorylation ...


Eur J Med Chem 178: 530-543 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.057
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 7


(Homo sapiens (Human))
BDBM50516387
PNG
(CHEMBL4515859)
Show SMILES Fc1cccc(F)c1C(=O)c1c[nH]c(c1)C(=O)Nc1cccnc1
Show InChI InChI=1S/C17H11F2N3O2/c18-12-4-1-5-13(19)15(12)16(23)10-7-14(21-8-10)17(24)22-11-3-2-6-20-9-11/h1-9,21H,(H,22,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Newcastle University

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His-tagged human ERK5 (2 to 409 residues) co-expressed with GST-tagged human truncated MEK5DD lacking N-terminal...


Eur J Med Chem 178: 530-543 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.057
More data for this
Ligand-Target Pair