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BDBM50326757 1-(3,5-dichlorophenyl)-4-methyl-5-methylene-2-oxo-2,5-dihydro-1H-pyrrole-3-carbonitrile::CHEMBL1253760

SMILES: CC1=C(C#N)C(=O)N(C1=C)c1cc(Cl)cc(Cl)c1

InChI Key: InChIKey=MIVMWMWJXZIPMS-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50326757   
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)
BDBM50326757
PNG
(1-(3,5-dichlorophenyl)-4-methyl-5-methylene-2-oxo-...)
Show SMILES CC1=C(C#N)C(=O)N(C1=C)c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C13H8Cl2N2O/c1-7-8(2)17(13(18)12(7)6-16)11-4-9(14)3-10(15)5-11/h3-5H,2H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.75E+4n/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