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BDBM50303596 CHEMBL566100::N-(4-(3-(3-(3-tert-butyl-1-p-tolyl-1H-pyrazol-5-yl)ureido)phenylamino)quinolin-6-yl)propionamide

SMILES: CCC(=O)Nc1ccc2nccc(Nc3cccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c3)c2c1

InChI Key: InChIKey=NOYDIAJXEFJPNS-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50303596   
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))
BDBM50303596
PNG
(CHEMBL566100 | N-(4-(3-(3-(3-tert-butyl-1-p-tolyl-...)
Show SMILES CCC(=O)Nc1ccc2nccc(Nc3cccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c3)c2c1
Show InChI InChI=1S/C33H35N7O2/c1-6-31(41)36-24-12-15-27-26(19-24)28(16-17-34-27)35-22-8-7-9-23(18-22)37-32(42)38-30-20-29(33(3,4)5)39-40(30)25-13-10-21(2)11-14-25/h7-20H,6H2,1-5H3,(H,34,35)(H,36,41)(H2,37,38,42)
PDB
MMDB

NCI pathway
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UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



Chemical Genomics Centre of the Max Planck Society

Curated by ChEMBL


Assay Description
Displacemnt of N,N'-(2,2'-(3,3'-disulfanediylbis(2,5-dioxopyrrolidine-3,1-diyl))bis(ethane-2,1-diyl))bis(2-(3-(3-tert-butyl-5-(3-naphthalen-1-ylureid...


J Med Chem 53: 357-67 (2010)


Article DOI: 10.1021/jm901297e
BindingDB Entry DOI: 10.7270/Q29W0FKC
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50303596
PNG
(CHEMBL566100 | N-(4-(3-(3-(3-tert-butyl-1-p-tolyl-...)
Show SMILES CCC(=O)Nc1ccc2nccc(Nc3cccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c3)c2c1
Show InChI InChI=1S/C33H35N7O2/c1-6-31(41)36-24-12-15-27-26(19-24)28(16-17-34-27)35-22-8-7-9-23(18-22)37-32(42)38-30-20-29(33(3,4)5)39-40(30)25-13-10-21(2)11-14-25/h7-20H,6H2,1-5H3,(H,34,35)(H,36,41)(H2,37,38,42)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 140n/an/an/an/an/an/a



Chemical Genomics Centre of the Max Planck Society

Curated by ChEMBL


Assay Description
Inhibition of p38alpha active form expressed in Escherichia coli BL21(DE3) cells by HTRF assay


J Med Chem 53: 357-67 (2010)


Article DOI: 10.1021/jm901297e
BindingDB Entry DOI: 10.7270/Q29W0FKC
More data for this
Ligand-Target Pair