Reaction Details Report a problem with these data
Target
Serine protease 1
Ligand
BDBM50003737
Substrate
n/a
Meas. Tech.
ChEMBL_212511 (CHEMBL817576)
Ki
670±n/a nM
Citation
 Rai, R; Katzenellenbogen, JA Effect of conformational mobility and hydrogen-bonding interactions on the selectivity of some guanidinoaryl-substituted mechanism-based inhibitors of trypsin-like serine proteases. J Med Chem 35:4297-305 (1992) [PubMed]  Article 
Target
Name:
Serine protease 1
Synonyms:
Beta-Trypsin | Cationic trypsin | PRSS1 | TRP1 | TRY1 | TRY1_BOVIN | TRYP1 | Trypsin | Trypsin I
Type:
Enzyme
Mol. Mass.:
25790.52
Organism:
Bos taurus (bovine)
Description:
P00760
Residue:
246
Sequence:
MKTFIFLALLGAAVAFPVDDDDKIVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN
  
Inhibitor
Name:
BDBM50003737
Synonyms:
(Lactone4)N-[4-(4-Guanidino-phenyl)-6-iodomethylene-2-oxo-tetrahydro-pyran-3-yl]-benzamide | CHEMBL135724
Type:
Small organic molecule
Emp. Form.:
C20H19IN4O3
Mol. Mass.:
490.2943
SMILES:
[#7]\[#6](-[#7])=[#7]\c1ccc(cc1)-[#6]-1-[#6]\[#6](-[#8]-[#6](=O)-[#6]-1-[#7]-[#6](=O)-c1ccccc1)=[#6]\I
Structure:
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