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SMILES: Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(N)=O

InChI Key: InChIKey=DOYRXRPIGYVHOQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50348318   
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))
BDBM50348318
PNG
(CHEMBL1800917 | US8772288, 6)
Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(N)=O
Show InChI InChI=1S/C20H20N2O2/c1-12-4-5-14(18(21)23)10-15(12)13-6-7-16-17(11-13)22-19(24)20(16)8-2-3-9-20/h4-7,10-11H,2-3,8-9H2,1H3,(H2,21,23)(H,22,24)
PDB
MMDB

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Article
PubMed
n/an/a 9n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human p38alpha by FRET assay


Bioorg Med Chem Lett 21: 4130-3 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.114
BindingDB Entry DOI: 10.7270/Q2NP25DM
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50348318
PNG
(CHEMBL1800917 | US8772288, 6)
Show SMILES Cc1ccc(cc1-c1ccc2c(NC(=O)C22CCCC2)c1)C(N)=O
Show InChI InChI=1S/C20H20N2O2/c1-12-4-5-14(18(21)23)10-15(12)13-6-7-16-17(11-13)22-19(24)20(16)8-2-3-9-20/h4-7,10-11H,2-3,8-9H2,1H3,(H2,21,23)(H,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

US Patent
n/an/a 8.5n/an/an/an/a7.525



Almirall, S.A.

US Patent


Assay Description
Enzymatic activity assay was performed in 96-well microtiter plates (Corning, catalog number #3686) using a total volume of 50 ul of an assay buffer ...


US Patent US8772288 (2014)


BindingDB Entry DOI: 10.7270/Q2T152BM
More data for this
Ligand-Target Pair