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Target
Serine protease HTRA1
Ligand
BDBM499306
Substrate
n/a
Meas. Tech.
Enzyme Inhibition Assay
IC50
1.90±n/a nM
Citation
 Hornsperger, B; Iacone, R; Maerki, HP; Mohr, P; Reutlinger, M Trifluoromethylpropanamide derivatives as HTRA1 inhibitors US Patent  US11014963 Publication Date 5/25/2021 
Target
Name:
Serine protease HTRA1
Synonyms:
HTRA | HTRA1 | HTRA1_HUMAN | PRSS11
Type:
Protein
Mol. Mass.:
51293.95
Organism:
Homo sapiens (Human)
Description:
Q92743
Residue:
480
Sequence:
MQIPRAALLPLLLLLLAAPASAQLSRAGRSAPLAAGCPDRCEPARCPPQPEHCEGGRARDACGCCEVCGAPEGAACGLQEGPCGEGLQCVVPFGVPASATVRRRAQAGLCVCASSEPVCGSDANTYANLCQLRAASRRSERLHRPPVIVLQRGACGQGQEDPNSLRHKYNFIADVVEKIAPAVVHIELFRKLPFSKREVPVASGSGFIVSEDGLIVTNAHVVTNKHRVKVELKNGATYEAKIKDVDEKADIALIKIDHQGKLPVLLLGRSSELRPGEFVVAIGSPFSLQNTVTTGIVSTTQRGGKELGLRNSDMDYIQTDAIINYGNSGGPLVNLDGEVIGINTLKVTAGISFAIPSDKIKKFLTESHDRQAKGKAITKKKYIGIRMMSLTSSKAKELKDRHRDFPDVISGAYIIEVIPDTPAEAGGLKENDVIISINGQSVVSANDVSDVIKRESTLNMVVRRGNEDIMITVIPEEIDP
  
Inhibitor
Name:
BDBM499306
Synonyms:
N-[(5S)-5-[[2-(3,4-Dichlorophenyl)-2,2-difluoroacetyl]amino]-6-[[(1S)-1-(4-methoxyphenyl)-2-oxo-2-[[(3S)-1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl]amino]ethyl]amino]-6-oxohexyl]pyridine-2-carboxamide | US11014963, Example 211
Type:
Small organic molecule
Emp. Form.:
C35H36Cl2F5N5O6
Mol. Mass.:
788.588
SMILES:
COc1ccc(cc1)[C@H](NC(=O)[C@H](CCCCNC(=O)c1ccccn1)NC(=O)C(F)(F)c1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](C(C)C)C(=O)C(F)(F)F |r|
Structure:
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