Reaction Details Report a problem with these data
Target
Meprin A subunit beta
Ligand
BDBM50455681
Substrate
n/a
Meas. Tech.
ChEMBL_1754851 (CHEMBL4189611)
IC50
1280±n/a nM
Citation
 Ramsbeck, D; Hamann, A; Richter, G; Schlenzig, D; Geissler, S; Nykiel, V; Cynis, H; Schilling, S; Buchholz, M Structure-Guided Design, Synthesis, and Characterization of Next-Generation Meprin ? Inhibitors. J Med Chem 61:4578-4592 (2018) [PubMed]  Article 
Target
Name:
Meprin A subunit beta
Synonyms:
3.4.24.63 | Endopeptidase-2 | MEP1B | MEP1B_HUMAN | Meprin A subunit beta | Meprin B | N-benzoyl-L-tyrosyl-P-amino-benzoic acid hydrolase subunit beta | PABA peptide hydrolase | PPH beta
Type:
PROTEIN
Mol. Mass.:
79560.71
Organism:
Homo sapiens
Description:
ChEMBL_117484
Residue:
701
Sequence:
MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF
  
Inhibitor
Name:
BDBM50455681
Synonyms:
CHEMBL4213564
Type:
Small organic molecule
Emp. Form.:
C23H22N2O4
Mol. Mass.:
390.4318
SMILES:
ONC(=O)CN(Cc1ccc(cc1)-c1ccccc1)Cc1cccc(c1)C(O)=O
Structure:
Search PDB for entries with ligand similarity: