Reaction Details Report a problem with these data
Target
Trypsin
Ligand
BDBM50069104
Substrate
n/a
Meas. Tech.
High-Throughput Screening Assay
IC50
19600±2700 nM
Citation
 Vasioukhin, VI; Chevillet, JR Hepsin inhibitors US Patent  US9182402 Publication Date 11/10/2015 
Target
Name:
Trypsin
Synonyms:
TRYP_PIG
Type:
PROTEIN
Mol. Mass.:
24411.24
Organism:
Sus scrofa
Description:
ChEMBL_1450738
Residue:
231
Sequence:
FPTDDDDKIVGGYTCAANSIPYQVSLNSGSHFCGGSLINSQWVVSAAHCYKSRIQVRLGEHNIDVLEGNEQFINAAKIITHPNFNGNTLDNDIMLIKLSSPATLNSRVATVSLPRSCAAAGTECLISGWGNTKSSGSSYPSLLQCLKAPVLSDSSCKSSYPGQITGNMICVGFLEGGKDSCQGDSGGPVVCNGQLQGIVSWGYGCAQKNKPGVYTKVCNYVNWIQQTIAAN
  
Inhibitor
Name:
BDBM50069104
Synonyms:
CHEMBL1449583 | US9182402, 4
Type:
Small organic molecule
Emp. Form.:
C18H16N2
Mol. Mass.:
260.333
SMILES:
Cc1cccc(c1)C1Nc2cccc3cccc(N1)c23
Structure:
Search PDB for entries with ligand similarity: