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TargetPlasma kallikrein
LigandBDBM50032870
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1443466 (CHEMBL3377180)
Ki 5023±n/a nM
Citation Hangeland, JJFriends, TJRossi, KASmallheer, JMWang, CSun, ZCorte, JRFang, TWong, PCRendina, ARBarbera, FABozarth, JMLuettgen, JMWatson, CAZhang, GWei, ARamamurthy, VMorin, PEBisacchi, GSSubramaniam, SArunachalam, PMathur, ASeiffert, DAWexler, RRQuan, ML Phenylimidazoles as potent and selective inhibitors of coagulation factor XIa with in vivo antithrombotic activity. J Med Chem57:9915-32 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Plasma kallikrein
Name:Plasma kallikrein
Synonyms:Fletcher factor | KLK3 | KLKB1 | KLKB1_HUMAN | Kallikrein | Kininogenin | Plasma kallikrein heavy chain | Plasma kallikrein light chain | Plasma prekallikrein
Type:Protein
Mol. Mass.:71391.16
Organism:Homo sapiens (Human)
Description:P03952
Residue:638
Sequence:
MILFKQATYFISLFATVSCGCLTQLYENAFFRGGDVASMYTPNAQYCQMRCTFHPRCLLF
SFLPASSINDMEKRFGCFLKDSVTGTLPKVHRTGAVSGHSLKQCGHQISACHRDIYKGVD
MRGVNFNVSKVSSVEECQKRCTSNIRCQFFSYATQTFHKAEYRNNCLLKYSPGGTPTAIK
VLSNVESGFSLKPCALSEIGCHMNIFQHLAFSDVDVARVLTPDAFVCRTICTYHPNCLFF
TFYTNVWKIESQRNVCLLKTSESGTPSSSTPQENTISGYSLLTCKRTLPEPCHSKIYPGV
DFGGEELNVTFVKGVNVCQETCTKMIRCQFFTYSLLPEDCKEEKCKCFLRLSMDGSPTRI
AYGTQGSSGYSLRLCNTGDNSVCTTKTSTRIVGGTNSSWGEWPWQVSLQVKLTAQRHLCG
GSLIGHQWVLTAAHCFDGLPLQDVWRIYSGILNLSDITKDTPFSQIKEIIIHQNYKVSEG
NHDIALIKLQAPLNYTEFQKPICLPSKGDTSTIYTNCWVTGWGFSKEKGEIQNILQKVNI
PLVTNEECQKRYQDYKITQRMVCAGYKEGGKDACKGDSGGPLVCKHNGMWRLVGITSWGE
GCARREQPGVYTKVAEYMDWILEKTQSSDGKAQMQSPA
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  Blast E-value cutoff:
BDBM50032870
n/a
NameBDBM50032870
Synonyms:CHEMBL3355687
TypeSmall organic molecule
Emp. Form.C25H30N4O
Mol. Mass.402.5319
SMILESNC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](Cc1ccccc1)c1cc(n[nH]1)-c1ccccc1 |r,wU:5.8,wD:11.11,2.1,(30.8,-41.53,;29.47,-42.3,;28.13,-41.53,;28.13,-39.99,;26.8,-39.22,;25.46,-39.99,;25.46,-41.53,;26.8,-42.3,;24.13,-39.22,;24.13,-37.68,;22.8,-39.99,;21.46,-39.22,;21.46,-37.68,;20.13,-36.91,;18.8,-37.68,;17.46,-36.91,;17.46,-35.37,;18.8,-34.6,;20.13,-35.37,;20.17,-40.06,;18.74,-39.51,;17.77,-40.7,;18.6,-42,;20.09,-41.6,;16.23,-40.62,;15.39,-41.92,;13.86,-41.83,;13.16,-40.46,;14,-39.17,;15.52,-39.25,)|
Structure
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