Reaction Details |
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Target | Plasminogen activator inhibitor 1 |
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Ligand | BDBM50132874 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_155612 |
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IC50 | 530±n/a nM |
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Citation | Ye, B; Bauer, S; Buckman, BO; Ghannam, A; Griedel, BD; Khim, SK; Lee, W; Sacchi, KL; Shaw, KJ; Liang, A; Wu, Q; Zhao, Z Synthesis and biological evaluation of menthol-based derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1). Bioorg Med Chem Lett13:3361-5 (2003) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Plasminogen activator inhibitor 1 |
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Name: | Plasminogen activator inhibitor 1 |
Synonyms: | Endothelial plasminogen activator inhibitor | PAI | PAI-1 | PAI1 | PAI1_HUMAN | PLANH1 | Plasminogen activator inhibitor 1 | Plasminogen activator inhibitor 1 (PAI-1) | Plasminogen activator inhibitor-1 | Plasminogen activator-1 (PAI-1) | SERPINE1 |
Type: | Enzyme |
Mol. Mass.: | 45064.00 |
Organism: | Homo sapiens (Human) |
Description: | P05121 |
Residue: | 402 |
Sequence: | MQMSPALTCLVLGLALVFGEGSAVHHPPSYVAHLASDFGVRVFQQVAQASKDRNVVFSPY
GVASVLAMLQLTTGGETQQQIQAAMGFKIDDKGMAPALRHLYKELMGPWNKDEISTTDAI
FVQRDLKLVQGFMPHFFRLFRSTVKQVDFSEVERARFIINDWVKTHTKGMISNLLGKGAV
DQLTRLVLVNALYFNGQWKTPFPDSSTHRRLFHKSDGSTVSVPMMAQTNKFNYTEFTTPD
GHYYDILELPYHGDTLSMFIAAPYEKEVPLSALTNILSAQLISHWKGNMTRLPRLLVLPK
FSLETEVDLRKPLENLGMTDMFRQFQADFTSLSDQEPLHVAQALQKVKIEVNESGTVASS
STAVIVSARMAPEEIIMDRPFLFVVRHNPTGTVLFMGQVMEP
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BDBM50132874 |
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n/a |
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Name | BDBM50132874 |
Synonyms: | 3-Hydroxy-4-({6-[2-((1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyloxy)-acetylamino]-pyridin-3-ylamino}-methyl)-8-methoxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-6-carboxylic acid | CHEMBL113249 |
Type | Small organic molecule |
Emp. Form. | C35H41N3O9 |
Mol. Mass. | 647.7147 |
SMILES | COc1cc(C(O)=O)c2Oc3c(CNc4ccc(NC(=O)CO[C@@H]5C[C@H](C)CC[C@H]5C(C)C)nc4)c(O)cc(C)c3C(=O)Oc2c1C |
Structure |
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