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BDBM50326771 4-isobutyl-1-mesityl-5-methylene-2-oxo-2,5-dihydro-1H-pyrrole-3-carbonitrile::CHEMBL1253939

SMILES: CC(C)CC1=C(C#N)C(=O)N(C1=C)c1c(C)cc(C)cc1C

InChI Key: InChIKey=OITFROHSZHTQCD-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50326771   
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
Ecdysone receptor


(Lucilia cuprina)
BDBM50326771
PNG
(4-isobutyl-1-mesityl-5-methylene-2-oxo-2,5-dihydro...)
Show SMILES CC(C)CC1=C(C#N)C(=O)N(C1=C)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C19H22N2O/c1-11(2)7-16-15(6)21(19(22)17(16)10-20)18-13(4)8-12(3)9-14(18)5/h8-9,11H,6-7H2,1-5H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.75E+5n/an/an/an/an/an/a



CSIRO Molecular and Health Technologies

Curated by ChEMBL


Assay Description
Binding affinity to Lucilia cuprina recombinant ecdysone receptor ligand binding domain after 3 hrs by fluorescence polarization assay


Bioorg Med Chem 18: 5647-60 (2010)


Article DOI: 10.1016/j.bmc.2010.06.020
BindingDB Entry DOI: 10.7270/Q2MK6D43
More data for this
Ligand-Target Pair