Reaction Details Report a problem with these data
Target
Prostaglandin G/H synthase 2 [E165G]
Ligand
BDBM173527
Substrate
n/a
Meas. Tech.
In vitro Cyclooxygenase (COX) Inhibition Assay
IC50
2.9e+3±n/a nM
Citation
 Abdellatif, KR; Elshemy, HA; Azoz, AA 1-(4-Methane(amino)sulfonylphenyl)-3-(4-substituted-phenyl)-5-(4-trifluoromethylphenyl)-1H-2-pyrazolines/pyrazoles as potential anti-inflammatory agents. Bioorg Chem 63:13-23 (2015) [PubMed]  Article 
Target
Name:
Prostaglandin G/H synthase 2 [E165G]
Synonyms:
COX2 | Cyclooxygenase-2 (COX-2) | PGH2_HUMAN | PTGS2
Type:
Protein
Mol. Mass.:
68932.84
Organism:
Homo sapiens (Human)
Description:
P35354[E165G]
Residue:
604
Sequence:
MLARALLLCAVLALSHTANPCCSHPCQNRGVCMSVGFDQYKCDCTRTGFYGENCSTPEFLTRIKLFLKPTPNTVHYILTHFKGFWNVVNNIPFLRNAIMSYVLTSRSHLIDSPPTYNADYGYKSWEAFSNLSYYTRALPPVPDDCPTPLGVKGKKQLPDSNEIVGKLLLRRKFIPDPQGSNMMFAFFAQHFTHQFFKTDHKRGPAFTNGLGHGVDLNHIYGETLARQRKLRLFKDGKMKYQIIDGEMYPPTVKDTQAEMIYPPQVPEHLRFAVGQEVFGLVPGLMMYATIWLREHNRVCDVLKQEHPEWGDEQLFQTSRLILIGETIKIVIEDYVQHLSGYHFKLKFDPELLFNKQFQYQNRIAAEFNTLYHWHPLLPDTFQIHDQKYNYQQFIYNNSILLEHGITQFVESFTRQIAGRVAGGRNVPPAVQKVSQASIDQSRQMKYQSFNEYRKRFMLKPYESFEELTGEKEMSAELEALYGDIDAVELYPALLVEKPRPDAIFGETMVEVGAPFSLKGLMGNVICSPAYWKPSTFGGEVGFQIINTASIQSLICNNVKGCPFTSFSVPDPELIKTVTINASSSRSGLDDINPTVLLKERSTEL
  
Inhibitor
Name:
BDBM173527
Synonyms:
1-(4-Aminosulfonylphenyl)-3-(4-ethoxyphenyl)-5-(4-trifluoromethylphenyl)-1H-pyrazole (15j)
Type:
Small organic molecule
Emp. Form.:
C24H20F3N3O3S
Mol. Mass.:
487.494
SMILES:
CCOc1ccc(cc1)-c1cc(-c2ccc(cc2)C(F)(F)F)n(n1)-c1ccc(cc1)S(N)(=O)=O
Structure:
Search PDB for entries with ligand similarity: