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BDBM50488452 CHEMBL2286442

SMILES: CCCCCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1Cl)C(C)(C)C

InChI Key: InChIKey=LJKDYBDUENVZQS-UHFFFAOYSA-N

Data: 2 EC50

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 2 hits for monomerid = 50488452   
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


(Bombyx mori)
BDBM50488452
PNG
(CHEMBL2286442)
Show SMILES CCCCCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1Cl)C(C)(C)C
Show InChI InChI=1S/C25H33ClN2O2/c1-7-8-9-10-19-11-13-20(14-12-19)23(29)27-28(25(4,5)6)24(30)21-16-17(2)15-18(3)22(21)26/h11-16H,7-10H2,1-6H3,(H,27,29)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.78E+3n/an/an/an/a



Ghent University

Curated by ChEMBL


Assay Description
Agonist activity at ecdysone receptor in Bombyx mori Bm5 cells after 24 hr by luciferase reporter gene assay


Pest Manag Sci 66: 526-35 (2010)


Article DOI: 10.1002/ps.1903
BindingDB Entry DOI: 10.7270/Q2KK9FPH
More data for this
Ligand-Target Pair
Ecdysone receptor


(Spodoptera littoralis)
BDBM50488452
PNG
(CHEMBL2286442)
Show SMILES CCCCCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1Cl)C(C)(C)C
Show InChI InChI=1S/C25H33ClN2O2/c1-7-8-9-10-19-11-13-20(14-12-19)23(29)27-28(25(4,5)6)24(30)21-16-17(2)15-18(3)22(21)26/h11-16H,7-10H2,1-6H3,(H,27,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 3.55E+3n/an/an/an/a



Ghent University

Curated by ChEMBL


Assay Description
Agonist activity at ecdysone receptor in Spodoptera littoralis Sl2 cells after 24 hr by luciferase reporter gene assay


Pest Manag Sci 66: 526-35 (2010)


Article DOI: 10.1002/ps.1903
BindingDB Entry DOI: 10.7270/Q2KK9FPH
More data for this
Ligand-Target Pair