Reaction Details |
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Target | Prostaglandin E synthase |
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Ligand | BDBM50512726 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1849815 (CHEMBL4350356) |
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IC50 | 84±n/a nM |
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Citation | Koppitz, M; Bräuer, N; Ter Laak, A; Irlbacher, H; Rotgeri, A; Coelho, AM; Walter, D; Steinmeyer, A; Zollner, TM; Peters, M; Nagel, J Discovery and optimization of pyridyl-cycloalkyl-carboxylic acids as inhibitors of microsomal prostaglandin E synthase-1 for the treatment of endometriosis. Bioorg Med Chem Lett29:2700-2705 (2019) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Prostaglandin E synthase |
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Name: | Prostaglandin E synthase |
Synonyms: | 5.3.99.3 | Microsomal prostaglandin E synthase 1 | PTGES_MOUSE | Pges | Prostaglandin E synthase | Ptges | mPGES-1 |
Type: | PROTEIN |
Mol. Mass.: | 17293.88 |
Organism: | Mus musculus |
Description: | ChEMBL_104562 |
Residue: | 153 |
Sequence: | MPSPGLVMESGQVLPAFLLCSTLLVIKMYAVAVITGQMRLRKKAFANPEDALKRGGLQYY
RSDPDVERCLRAHRNDMETIYPFLFLGFVYSFLGPNPLIAWIHFLVVLTGRVVHTVAYLG
KLNPRLRSGAYVLAQFSCFSMALQILWEVAHHL
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BDBM50512726 |
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n/a |
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Name | BDBM50512726 |
Synonyms: | CHEMBL4459950 |
Type | Small organic molecule |
Emp. Form. | C34H42N2O3 |
Mol. Mass. | 526.7089 |
SMILES | CC[C@@H](CC(O)=O)c1cccc(NC(=O)C(C2CCCC2)c2ccc(cc2)-c2cncc(CC(C)C)c2)c1C |r| |
Structure |
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