Reaction Details Report a problem with these data
Target
Serine protease 1
Ligand
BDBM50084189
Substrate
n/a
Meas. Tech.
ChEMBL_212319 (CHEMBL815005)
Ki
160±n/a nM
Citation
Guilford, WJ; Shaw, KJ; Dallas, JL; Koovakkat, S; Lee, W; Liang, A; Light, DR; McCarrick, MA; Whitlow, M; Ye, B; Morrissey, MM Synthesis, characterization, and structure-activity relationships of amidine-substituted (bis)benzylidene-cycloketone olefin isomers as potent and selective factor Xa inhibitors. J Med Chem 42:5415-25 (2000) [PubMed] Article
More Info.:
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:
Bovine
Description:
P00760
Residue:
246
Sequence:
MKTFIFLALLGAAVAFPVDDDDKIVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN
Inhibitor
Name:
BDBM50084189
Synonyms:
2-[1-[4-amino(imino)methylphenyl]-(E)-methylidene]-6-[1-[4-amino(imino)methylphenyl]-(Z)-methylidene]-4-phenyl-1-cyclohexanone | CHEMBL150612
Type:
Small organic molecule
Emp. Form.:
C28H26N4O
Mol. Mass.:
434.5322
SMILES:
NC(=N)c1ccc(\C=C2\CC(C\C(=C/c3ccc(cc3)C(N)=N)C2=O)c2ccccc2)cc1