Reaction Details |
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Target | Snake venom metalloproteinase BaP1 |
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Ligand | BDBM50292332 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_840308 (CHEMBL2091265) |
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IC50 | 93300±n/a nM |
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Citation | Villalta-Romero, F; Gortat, A; Herrera, AE; Arguedas, R; Quesada, J; de Melo, RL; Calvete, JJ; Montero, M; Murillo, R; Rucavado, A; Gutiérrez, JM; Pérez-Payá, E Identification of new snake venom metalloproteinase inhibitors using compound screening and rational Peptide design. ACS Med Chem Lett3:540-543 (2012) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Snake venom metalloproteinase BaP1 |
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Name: | Snake venom metalloproteinase BaP1 |
Synonyms: | Bap-1 | Hemorrhagic metalloproteinase BaP1 | SVMP | VM1B1_BOTAS |
Type: | PROTEIN |
Mol. Mass.: | 45929.07 |
Organism: | Bothrops asper |
Description: | ChEMBL_840308 |
Residue: | 408 |
Sequence: | MIEVLLVTICLAVFPYQGSSIILESGNVNDYEVVYPRKVTELPKGAVQPKYEDAMQYEFK
VNGEPVVLHLEKNKGLFSEDYSETHYSPDGRKIITYPSFEDHCYYHGRIENDADSTASIS
ACNGLKGHFKLQGETYLIEPLKLSDSEAHAVYKYENVEKEDEAPKMCGVTETNWESYEPI
KKASQSNLTPEQQRFSPRYIELAVVADHGIFTKYNSNLNTIRTRVHEMLNTVNGFYRSVD
VHAPLANLEVWSKQDLIKVQKDSSKTLKSFGEWRERDLLPRISHDHAQLLTAVVFDGNTI
GRAYTGGMCDPRHSVGVVRDHSKNNLWVAVTMAHELGHNLGIHHDTGSCSCGAKSCIMAS
VLSKVLSYEFSDCSQNQYETYLTNHNPQCILNKPLLTVSGNELLEAGE
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BDBM50292332 |
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n/a |
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Name | BDBM50292332 |
Synonyms: | 2,3,9,10-Tetramethoxy-5,6-dihydro-isoquino[3,2-a]isoquinolinylium; chloride | 2,3,9,10-tetramethoxy-5,6-dihydro-isoquino[3,2-a]isoquinolinylium | CHEMBL1270849 | CHEMBL2163795 | CHEMBL274189 | GNF-Pf-4086 | PALMATINE |
Type | Small organic molecule |
Emp. Form. | C21H22NO4 |
Mol. Mass. | 352.4031 |
SMILES | COc1cc2CC[n+]3cc4c(OC)c(OC)ccc4cc3-c2cc1OC |
Structure |
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