Reaction Details Report a problem with these data
Target
Anionic trypsin-2
Ligand
BDBM50084617
Substrate
n/a
Meas. Tech.
ChEBML_213052
IC50
63±n/a nM
Citation
Huang, W; Zhang, P; Zuckett, JF; Wang, L; Woolfrey, J; Song, Y; Jia, ZJ; Clizbe, LA; Su, T; Tran, K; Huang, B; Wong, P; Sinha, U; Park, G; Reed, A; Malinowski, J; Hollenbach, SJ; Scarborough, RM; Zhu, BY Design, synthesis and structure-activity relationships of benzoxazinone-based factor Xa inhibitors. Bioorg Med Chem Lett 13:561-6 (2003) [PubMed] Article
More Info.:
Target
Name:
Anionic trypsin-2
Synonyms:
Prss2 | TRY2_RAT | Try2 | Trypsin II
Type:
PROTEIN
Mol. Mass.:
26220.44
Organism:
Rattus norvegicus
Description:
ChEMBL_213052
Residue:
246
Sequence:
MRALLFLALVGAAVAFPVDDDDKIVGGYTCQENSVPYQVSLNSGYHFCGGSLINDQWVVSAAHCYKSRIQVRLGEHNINVLEGNEQFVNAAKIIKHPNFDRKTLNNDIMLIKLSSPVKLNARVATVALPSSCAPAGTQCLISGWGNTLSSGVNEPDLLQCLDAPLLPQADCEASYPGKITDNMVCVGFLEGGKDSCQGDSGGPVVCNGELQGIVSWGYGCALPDNPGVYTKVCNYVDWIQDTIAAN
Inhibitor
Name:
BDBM50084617
Synonyms:
((7-carbamimidoyl-naphthalen-2-ylmethyl)-{4-[1-(1-imino-ethyl)-piperidin-4-yloxy]-phenyl}-sulfamoyl)-acetic acid | CHEMBL20240 | YM-60828
Type:
Small organic molecule
Emp. Form.:
C27H31N5O5S
Mol. Mass.:
537.631
SMILES:
CC(=N)N1CCC(CC1)Oc1ccc(cc1)N(Cc1ccc2ccc(cc2c1)C(N)=N)S(=O)(=O)CC(O)=O