Target
Prostaglandin G/H synthase 1
Ligand
BDBM50078684
Substrate
n/a
Meas. Tech.
ChEBML_158735
IC50
5800±n/a nM
Citation
 Prasit, PWang, ZBrideau, CChan, CCCharleson, SCromlish, WEthier, DEvans, JFFord-Hutchinson, AWGauthier, JYGordon, RGuay, JGresser, MKargman, SKennedy, BLeblanc, YLéger, SMancini, JO'Neill, GPOuellet, MPercival, MDPerrier, HRiendeau, DRodger, IZamboni, R The discovery of rofecoxib, [MK 966, Vioxx, 4-(4'-methylsulfonylphenyl)-3-phenyl-2(5H)-furanone], an orally active cyclooxygenase-2-inhibitor. Bioorg Med Chem Lett 9:1773-8 (1999) [PubMed]  Article 
Target
Name:
Prostaglandin G/H synthase 1
Synonyms:
COX-1 | COX1 | Cyclooxygenase | Cyclooxygenase-1 | Cyclooxygenase-1 (COX-1) | PGH1_HUMAN | PTGS1 | Prostaglandin G/H synthase (cyclooxygenase)
Type:
Enzyme
Mol. Mass.:
68692.62
Organism:
Homo sapiens (Human)
Description:
P23219
Residue:
599
Sequence:
MSRSLLLWFLLFLLLLPPLPVLLADPGAPTPVNPCCYYPCQHQGICVRFGLDRYQCDCTRTGYSGPNCTIPGLWTWLRNSLRPSPSFTHFLLTHGRWFWEFVNATFIREMLMRLVLTVRSNLIPSPPTYNSAHDYISWESFSNVSYYTRILPSVPKDCPTPMGTKGKKQLPDAQLLARRFLLRRKFIPDPQGTNLMFAFFAQHFTHQFFKTSGKMGPGFTKALGHGVDLGHIYGDNLERQYQLRLFKDGKLKYQVLDGEMYPPSVEEAPVLMHYPRGIPPQSQMAVGQEVFGLLPGLMLYATLWLREHNRVCDLLKAEHPTWGDEQLFQTTRLILIGETIKIVIEEYVQQLSGYFLQLKFDPELLFGVQFQYRNRIAMEFNHLYHWHPLMPDSFKVGSQEYSYEQFLFNTSMLVDYGVEALVDAFSRQIAGRIGGGRNMDHHILHVAVDVIRESREMRLQPFNEYRKRFGMKPYTSFQELVGEKEMAAELEELYGDIDALEFYPGLLLEKCHPNSIFGESMIEIGAPFSLKGLLGNPICSPEYWKPSTFGGEVGFNIVKTATLKKLVCLNTKTCPYVSFRVPDASQDDGPAVERPSTEL
  
Inhibitor
Name:
BDBM50078684
Synonyms:
4-[4-(4-Fluoro-phenyl)-5-oxo-2,5-dihydro-furan-3-yl]-benzenesulfonamide | CHEMBL431546
Type:
Small organic molecule
Emp. Form.:
C16H12FNO4S
Mol. Mass.:
333.334
SMILES:
NS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccc(F)cc1 |t:11|
Structure:
Search PDB for entries with ligand similarity: