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BDBM50323427 CHEMBL1209482::N-(3-(3-tert-butyl-5-(3-phenylureido)-1H-pyrazol-1-yl)benzyl)-2-(2-oxopyridin-1(2H)-yl)acetamide

SMILES: CC(C)(C)c1cc(NC(=O)Nc2ccccc2)n(n1)-c1cccc(CNC(=O)Cn2ccccc2=O)c1

InChI Key: InChIKey=WGGHULRIQOEEDJ-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50323427   
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))
BDBM50323427
PNG
(CHEMBL1209482 | N-(3-(3-tert-butyl-5-(3-phenylurei...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccccc2)n(n1)-c1cccc(CNC(=O)Cn2ccccc2=O)c1
Show InChI InChI=1S/C28H30N6O3/c1-28(2,3)23-17-24(31-27(37)30-21-11-5-4-6-12-21)34(32-23)22-13-9-10-20(16-22)18-29-25(35)19-33-15-8-7-14-26(33)36/h4-17H,18-19H2,1-3H3,(H,29,35)(H2,30,31,37)
PDB
MMDB

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KEGG

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 63n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of active p38alpha


Bioorg Med Chem Lett 20: 4885-91 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.073
BindingDB Entry DOI: 10.7270/Q2Z31ZT2
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50323427
PNG
(CHEMBL1209482 | N-(3-(3-tert-butyl-5-(3-phenylurei...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccccc2)n(n1)-c1cccc(CNC(=O)Cn2ccccc2=O)c1
Show InChI InChI=1S/C28H30N6O3/c1-28(2,3)23-17-24(31-27(37)30-21-11-5-4-6-12-21)34(32-23)22-13-9-10-20(16-22)18-29-25(35)19-33-15-8-7-14-26(33)36/h4-17H,18-19H2,1-3H3,(H,29,35)(H2,30,31,37)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of unactive p38alpha


Bioorg Med Chem Lett 20: 4885-91 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.073
BindingDB Entry DOI: 10.7270/Q2Z31ZT2
More data for this
Ligand-Target Pair