Reaction Details Report a problem with these data
Target
Trypsin-3
Ligand
BDBM50387181
Substrate
n/a
Meas. Tech.
ChEMBL_827953 (CHEMBL2051532)
Ki
1094000±n/a nM
Citation
 Karle, M; Knecht, W; Xue, Y Discovery of benzothiazole guanidines as novel inhibitors of thrombin and trypsin IV. Bioorg Med Chem Lett 22:4839-43 (2012) [PubMed]  Article 
Target
Name:
Trypsin-3
Synonyms:
Brain trypsinogen | Mesotrypsinogen | PRSS3 | PRSS4 | Serine protease 3 | Serine protease 4 | TRY3 | TRY3_HUMAN | TRY4 | Thrombin & trypsin | Trypsin | Trypsin III | Trypsin IV | Trypsin-3
Type:
PROTEIN
Mol. Mass.:
32532.52
Organism:
Homo sapiens (Human)
Description:
ChEMBL_216043
Residue:
304
Sequence:
MCGPDDRCPARWPGPGRAVKCGKGLAAARPGRVERGGAQRGGAGLELHPLLGGRTWRAARDADGCEALGTVAVPFDDDDKIVGGYTCEENSLPYQVSLNSGSHFCGGSLISEQWVVSAAHCYKTRIQVRLGEHNIKVLEGNEQFINAAKIIRHPKYNRDTLDNDIMLIKLSSPAVINARVSTISLPTTPPAAGTECLISGWGNTLSFGADYPDELKCLDAPVLTQAECKASYPGKITNSMFCVGFLEGGKDSCQRDSGGPVVCNGQLQGVVSWGHGCAWKNRPGVYTKVYNYVDWIKDTIAANS
  
Inhibitor
Name:
BDBM50387181
Synonyms:
CHEMBL2047999
Type:
Small organic molecule
Emp. Form.:
C12H15N5O2S
Mol. Mass.:
293.345
SMILES:
CCNC(=O)Cn1c2ccc(O)cc2s\c1=N\C(N)=N
Structure:
Search PDB for entries with ligand similarity: