| Reaction Details |
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 | Report a problem with these data |
| Target | Coagulation factor XIII A chain |
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| Ligand | BDBM50420520 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_841034 (CHEMBL2091160) |
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| IC50 | >80000±n/a nM |
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| Citation |  Prime, ME; Andersen, OA; Barker, JJ; Brooks, MA; Cheng, RK; Toogood-Johnson, I; Courtney, SM; Brookfield, FA; Yarnold, CJ; Marston, RW; Johnson, PD; Johnsen, SF; Palfrey, JJ; Vaidya, D; Erfan, S; Ichihara, O; Felicetti, B; Palan, S; Pedret-Dunn, A; Schaertl, S; Sternberger, I; Ebneth, A; Scheel, A; Winkler, D; Toledo-Sherman, L; Beconi, M; Macdonald, D; Muñoz-Sanjuan, I; Dominguez, C; Wityak, J Discovery and structure-activity relationship of potent and selective covalent inhibitors of transglutaminase 2 for Huntington's disease. J Med Chem55:1021-46 (2012) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Coagulation factor XIII A chain |
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| Name: | Coagulation factor XIII A chain |
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| Synonyms: | Coagulation factor XIII | F13A | F13A1 | F13A_HUMAN |
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| Type: | PROTEIN |
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| Mol. Mass.: | 83261.29 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_1475048 |
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| Residue: | 732 |
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| Sequence: | MSETSRTAFGGRRAVPPNNSNAAEDDLPTVELQGVVPRGVNLQEFLNVTSVHLFKERWDT
NKVDHHTDKYENNKLIVRRGQSFYVQIDFSRPYDPRRDLFRVEYVIGRYPQENKGTYIPV
PIVSELQSGKWGAKIVMREDRSVRLSIQSSPKCIVGKFRMYVAVWTPYGVLRTSRNPETD
TYILFNPWCEDDAVYLDNEKEREEYVLNDIGVIFYGEVNDIKTRSWSYGQFEDGILDTCL
YVMDRAQMDLSGRGNPIKVSRVGSAMVNAKDDEGVLVGSWDNIYAYGVPPSAWTGSVDIL
LEYRSSENPVRYGQCWVFAGVFNTFLRCLGIPARIVTNYFSAHDNDANLQMDIFLEEDGN
VNSKLTKDSVWNYHCWNEAWMTRPDLPVGFGGWQAVDSTPQENSDGMYRCGPASVQAIKH
GHVCFQFDAPFVFAEVNSDLIYITAKKDGTHVVENVDATHIGKLIVTKQIGGDGMMDITD
TYKFQEGQEEERLALETALMYGAKKPLNTEGVMKSRSNVDMDFEVENAVLGKDFKLSITF
RNNSHNRYTITAYLSANITFYTGVPKAEFKKETFDVTLEPLSFKKEAVLIQAGEYMGQLL
EQASLHFFVTARINETRDVLAKQKSTVLTIPEIIIKVRGTQVVGSDMTVTVQFTNPLKET
LRNVWVHLDGPGVTRPMKKMFREIRPNSTVQWEEVCRPWVSGHRKLIASMSSDSLRHVYG
ELDVQIQRRPSM
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| BDBM50420520 |
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| n/a |
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| Name | BDBM50420520 |
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| Synonyms: | CHEMBL2089385 |
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| Type | Small organic molecule |
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| Emp. Form. | C33H46N8O7 |
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| Mol. Mass. | 666.7677 |
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| SMILES | CC(C)C[C@H](NC(=O)[C@H](CCC(=O)[CH-][N+]#N)NC(=O)[C@@H]1CCCN1C(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| |
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| Structure | 
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