| Reaction Details |
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 | Report a problem with these data |
| Target | Prostaglandin E synthase 2 |
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| Ligand | BDBM50006805 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_305014 (CHEMBL829449) |
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| IC50 | 1600±n/a nM |
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| Citation |  Riendeau, D; Aspiotis, R; Ethier, D; Gareau, Y; Grimm, EL; Guay, J; Guiral, S; Juteau, H; Mancini, JA; Méthot, N; Rubin, J; Friesen, RW Inhibitors of the inducible microsomal prostaglandin E2 synthase (mPGES-1) derived from MK-886. Bioorg Med Chem Lett15:3352-5 (2005) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Prostaglandin E synthase 2 |
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| Name: | Prostaglandin E synthase 2 |
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| Synonyms: | C9orf15 | PGES2 | PGES2_HUMAN | PTGES2 |
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| Type: | Enzyme |
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| Mol. Mass.: | 41955.21 |
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| Organism: | Homo sapiens (Human) |
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| Description: | Q9H7Z7 |
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| Residue: | 377 |
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| Sequence: | MDPAARVVRALWPGGCALAWRLGGRPQPLLPTQSRAGFAGAAGGPSPVAAARKGSPRLLG
AAALALGGALGLYHTARWHLRAQDLHAERSAAQLSLSSRLQLTLYQYKTCPFCSKVRAFL
DFHALPYQVVEVNPVRRAEIKFSSYRKVPILVAQEGESSQQLNDSSVIISALKTYLVSGQ
PLEEIITYYPAMKAVNEQGKEVTEFGNKYWLMLNEKEAQQVYGGKEARTEEMKWRQWADD
WLVHLISPNVYRTPTEALASFDYIVREGKFGAVEGAVAKYMGAAAMYLISKRLKSRHRLQ
DNVREDLYEAADKWVAAVGKDRPFMGGQKPNLADLAVYGVLRVMEGLDAFDDLMQHTHIQ
PWYLRVERAITEASPAH
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| BDBM50006805 |
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| n/a |
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| Name | BDBM50006805 |
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| Synonyms: | 3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isopropyl-1H-indol-2-yl)-2,2-dimethylpropanoic acid | 3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-isopropyl-1H-indol-2-yl)-2,2-dimethylpropanoic acid | 3-[1-(4-chlorobenzyl)-3-t-butyl-thio-5-isopropylindol-2-yl]-2,2-dimethylpropanoic acid | 3-[3-tert-Butylsulfanyl-1-(4-chloro-benzyl)-5-isopropyl-1H-indol-2-yl]-2,2-dimethyl-propionic acid | CHEMBL29097 | MK-886 | MK886 | cid_3651377 |
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| Type | Small organic molecule |
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| Emp. Form. | C27H34ClNO2S |
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| Mol. Mass. | 472.082 |
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| SMILES | CC(C)c1ccc2n(Cc3ccc(Cl)cc3)c(CC(C)(C)C(O)=O)c(SC(C)(C)C)c2c1 |
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| Structure | 
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