Reaction Details |
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Target | Coagulation factor XI |
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Ligand | BDBM50192107 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_404136 (CHEMBL909746) |
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IC50 | 1400±n/a nM |
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Citation | Lazarova, TI; Jin, L; Rynkiewicz, M; Gorga, JC; Bibbins, F; Meyers, HV; Babine, R; Strickler, J Synthesis and in vitro biological evaluation of aryl boronic acids as potential inhibitors of factor XIa. Bioorg Med Chem Lett16:5022-7 (2006) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Coagulation factor XI |
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Name: | Coagulation factor XI |
Synonyms: | Coagulation factor XIa | Coagulation factor XIa heavy chain | Coagulation factor XIa light chain | F11 | FA11_HUMAN | FXI | Factor XIa | Factor XIa (fXIa) | PTA | Plasma thromboplastin antecedent |
Type: | Enzyme |
Mol. Mass.: | 70130.58 |
Organism: | Homo sapiens (Human) |
Description: | P03951 |
Residue: | 625 |
Sequence: | MIFLYQVVHFILFTSVSGECVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFT
FTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDM
KGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITK
LDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFT
FFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTD
FLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKIL
HGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSI
IGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYD
IALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLV
TNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCA
QRERPGVYTNVVEYVDWILEKTQAV
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BDBM50192107 |
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n/a |
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Name | BDBM50192107 |
Synonyms: | CHEMBL211921 | pyridine-3-carboxylic acid guanidino-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-methyl ester trifluoro-acetic acid |
Type | Small organic molecule |
Emp. Form. | C20H25BN4O4 |
Mol. Mass. | 396.248 |
SMILES | [#6]C1([#6])[#8]-[#5](-[#8]C1([#6])[#6])-c1ccc(cc1)-[#6](-[#8]-[#6](=O)-c1cccnc1)\[#7]=[#6](\[#7])-[#7] |
Structure |
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