Reaction Details |
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Target | Serine protease 1 |
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Ligand | BDBM50069147 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_210652 (CHEMBL811614) |
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Ki | 36±n/a nM |
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Citation | Duncia, JV; Santella, JB; Higley, CA; VanAtten, MK; Weber, PC; Alexander, RS; Kettner, CA; Pruitt, JR; Liauw, AY; Quan, ML; Knabb, RM; Wexler, RR Pyrazoles, 1,2,4-triazoles, and tetrazoles as surrogates for cis-amide bonds in boronate ester thrombin inhibitors. Bioorg Med Chem Lett8:775-80 (1999) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Serine protease 1 |
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Name: | Serine protease 1 |
Synonyms: | Alpha-trypsin chain 1 | Alpha-trypsin chain 2 | Beta-trypsin | Cationic trypsinogen | PRSS1 | Serine protease 1 | TRP1 | TRY1 | TRY1_HUMAN | TRYP1 | Thrombin & trypsin | Trypsin | Trypsin I | Trypsin-1 |
Type: | Enzyme |
Mol. Mass.: | 26557.80 |
Organism: | Homo sapiens (Human) |
Description: | P07477 |
Residue: | 247 |
Sequence: | MNPLLILTFVAAALAAPFDDDDKIVGGYNCEENSVPYQVSLNSGYHFCGGSLINEQWVVS
AGHCYKSRIQVRLGEHNIEVLEGNEQFINAAKIIRHPQYDRKTLNNDIMLIKLSSRAVIN
ARVSTISLPTAPPATGTKCLISGWGNTASSGADYPDELQCLDAPVLSQAKCEASYPGKIT
SNMFCVGFLEGGKDSCQGDSGGPVVCNGQLQGVVSWGDGCAQKNKPGVYTKVYNYVKWIK
NTIAANS
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BDBM50069147 |
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n/a |
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Name | BDBM50069147 |
Synonyms: | (E)-3-(1-{[(R)-5-Amino-1-((1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-bora-tricyclo[6.1.1.0*2,6*]dec-4-yl)-pentylcarbamoyl]-methyl}-5-benzyl-1H-[1,2,4]triazol-3-yl)-acrylic acid tert-butyl ester | CHEMBL2373345 |
Type | Small organic molecule |
Emp. Form. | C33H48BN5O5 |
Mol. Mass. | 605.576 |
SMILES | [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(O[C@]1([H])C2)[C@H](CCCCN)NC(=O)Cn1nc(\C=C\C(=O)OC(C)(C)C)nc1Cc1ccccc1 |
Structure |
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