Reaction Details
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Prostaglandin G/H synthase 1
Ligand
BDBM50259818
Substrate
n/a
Meas. Tech.
ChEMBL_524792 (CHEMBL969190)
IC50
73900±n/a nM
Citation
Yoshikawa, K; Inoue, M; Matsumoto, Y; Sakakibara, C; Miyataka, H; Matsumoto, H; Arihara, S Lanostane triterpenoids and triterpene glycosides from the fruit body of Fomitopsis pinicola and their inhibitory activity against COX-1 and COX-2. J Nat Prod 68:69-73 (2005) [PubMed] Article More Info.:
Target
Name:
Prostaglandin G/H synthase 1
Synonyms:
Cyclooxygenase-1 | Cyclooxygenase-1 (COX-1) | PGH1_SHEEP | PTGS1 | COX1 | Prostaglandin G/H synthase (cyclooxygenase)
Type:
Protein
Mol. Mass.:
68868.60
Organism:
Sheep
Description:
n/a
Residue:
600
Sequence:
MSRQSISLRFPLLLLLLSPSPVFSADPGAPAPVNPCCYYPCQHQGICVRFGLDRYQCDCTRTGYSGPNCTIPEIWTWLRTTLRPSPSFIHFLLTHGRWLWDFVNATFIRDTLMRLVLTVRSNLIPSPPTYNIAHDYISWESFSNVSYYTRILPSVPRDCPTPMDTKGKKQLPDAEFLSRRFLLRRKFIPDPQSTNLMFAFFAQHFTHQFFKTSGKMGPGFTKALGHGVDLGHIYGDNLERQYQLRLFKDGKLKYQMLNGEVYPPSVEEAPVLMHYPRGIPPQSQMAVGQEVFGLLPGLMLYATIWLREHNRVCDLLKAEHPTWGDEQLFQTARLILIGETIKIVIEEYVQQLSGYFLQLKFDPELLFGAQFQYRNRIAMEFNQLYHWHPLMPDSFRVGPQDYSYEQFLFNTSMLVDYGVEALVDAFSRQPAGRIGGGRNIDHHILHVAVDVIKESRVLRLQPFNEYRKRFGMKPYTSFQELTGEKEMAAELEELYGDIDALEFYPGLLLEKCHPNSIFGESMIEMGAPFSLKGLLGNPICSPEYWKASTFGGEVGFNLVKTATLKKLVCLNTKTCPYVSFHVPDPRQEDRPGVERPPTEL
Inhibitor
Name:
BDBM50259818
Synonyms:
Fomitoside H | CHEMBL445461
Type:
Small organic molecule
Emp. Form.:
C42 H66 O11
Mol. Mass.:
746.96684
SMILES:
[#6]-[#8]-[#6](=O)-[#6]C([#6])([#8])[#6]-[#6](=O)-[#8]-[#6@@H]1-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-[#6]-[#6]3=[#6]2-[#6]-[#6][C@]2([#6])[#6@H](-[#6]-[#6][C@@]32[#6])-[#6@@H](-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6](=O)-[#8]-[#6@@H]-2-[#8]-[#6]-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-2-[#8])C1([#6])[#6] |r,c:20|
Structure:
