BindingDB logo
myBDB logout

BDBM50302402 7-bromo-2-(2-chloro-6-fluorophenyl)-1H-phenanthro[9,10-d]imidazole::CHEMBL566261

SMILES: Fc1cccc(Cl)c1-c1nc2c([nH]1)c1cccc(Br)c1c1ccccc21

InChI Key: InChIKey=KLDPORRVVYLMRJ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50302402   
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
Prostaglandin E synthase


(Homo sapiens (Human))
BDBM50302402
PNG
(7-bromo-2-(2-chloro-6-fluorophenyl)-1H-phenanthro[...)
Show SMILES Fc1cccc(Cl)c1-c1nc2c([nH]1)c1cccc(Br)c1c1ccccc21
Show InChI InChI=1S/C21H11BrClFN2/c22-14-8-3-7-13-17(14)11-5-1-2-6-12(11)19-20(13)26-21(25-19)18-15(23)9-4-10-16(18)24/h1-10H,(H,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Displacement of [3H]PGH2 from human recombinant PGES1 expressed in CHOK1 cells


Bioorg Med Chem Lett 19: 5837-41 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.085
BindingDB Entry DOI: 10.7270/Q2MG7PKK
More data for this
Ligand-Target Pair
Prostaglandin E synthase


(Homo sapiens (Human))
BDBM50302402
PNG
(7-bromo-2-(2-chloro-6-fluorophenyl)-1H-phenanthro[...)
Show SMILES Fc1cccc(Cl)c1-c1nc2c([nH]1)c1cccc(Br)c1c1ccccc21
Show InChI InChI=1S/C21H11BrClFN2/c22-14-8-3-7-13-17(14)11-5-1-2-6-12(11)19-20(13)26-21(25-19)18-15(23)9-4-10-16(18)24/h1-10H,(H,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibition of mPGES1 in IL-1beta-stimulated human A549 cells assessed as blockade of PGH2 to PGE2 conversion in presence of 50% fetal bovine serum


Bioorg Med Chem Lett 19: 5837-41 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.085
BindingDB Entry DOI: 10.7270/Q2MG7PKK
More data for this
Ligand-Target Pair