new BindingDB logo
myBDB logout

BDBM50090406 1-(5-(4,5-dihydrooxazol-2-yl)-2-(thiophen-2-yl)pyrimidin-4-ylamino)-3-methyl-1H-pyrrole-2,5-dione::1-[5-(4,5-Dihydro-oxazol-2-yl)-2-thiophen-2-yl-pyrimidin-4-ylamino]-3-methyl-pyrrole-2,5-dione::CHEMBL295508

SMILES: CC1=CC(=O)N(Nc2nc(ncc2C2=NCCO2)-c2cccs2)C1=O

InChI Key: InChIKey=PTHWPWGFLGQPPP-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50090406   
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
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50090406
PNG
(1-(5-(4,5-dihydrooxazol-2-yl)-2-(thiophen-2-yl)pyr...)
Show SMILES CC1=CC(=O)N(Nc2nc(ncc2C2=NCCO2)-c2cccs2)C1=O |t:1,14|
Show InChI InChI=1S/C16H13N5O3S/c1-9-7-12(22)21(16(9)23)20-13-10(15-17-4-5-24-15)8-18-14(19-13)11-3-2-6-25-11/h2-3,6-8H,4-5H2,1H3,(H,18,19,20)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 200n/an/an/an/an/an/a



Signal Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of AP-1 (activator protein-1) mediated transcriptional activation in Jurkat T-cells


Bioorg Med Chem Lett 10: 1645-8 (2000)


BindingDB Entry DOI: 10.7270/Q2F190XH
More data for this
Ligand-Target Pair