Reaction Details Report a problem with these data
Target
Matrix metalloproteinase-9
Ligand
BDBM50116280
Substrate
n/a
Meas. Tech.
ChEBML_71659
IC50
83000±n/a nM
Citation
 Wang, X; Choe, Y; Craik, CS; Ellman, JA Design and synthesis of novel inhibitors of gelatinase B. Bioorg Med Chem Lett 12:2201-4 (2002) [PubMed]  Article 
Target
Name:
Matrix metalloproteinase-9
Synonyms:
92 kDa gelatinase | 92 kDa type IV collagenase | Clg4b | GELB | Gelatinase B | MMP-9 | MMP9_MOUSE | Matrix metalloproteinase 9 | Matrix metalloproteinase-9 | Mmp9
Type:
PROTEIN
Mol. Mass.:
80529.41
Organism:
Mus musculus
Description:
ChEMBL_71659
Residue:
730
Sequence:
MSPWQPLLLALLAFGCSSAAPYQRQPTFVVFPKDLKTSNLTDTQLAEAYLYRYGYTRAAQMMGEKQSLRPALLMLQKQLSLPQTGELDSQTLKAIRTPRCGVPDVGRFQTFKGLKWDHHNITYWIQNYSEDLPRDMIDDAFARAFAVWGEVAPLTFTRVYGPEADIVIQFGVAEHGDGYPFDGKDGLLAHAFPPGAGVQGDAHFDDDELWSLGKGVVIPTYYGNSNGAPCHFPFTFEGRSYSACTTDGRNDGTPWCSTTADYDKDGKFGFCPSERLYTEHGNGEGKPCVFPFIFEGRSYSACTTKGRSDGYRWCATTANYDQDKLYGFCPTRVDATVVGGNSAGELCVFPFVFLGKQYSSCTSDGRRDGRLWCATTSNFDTDKKWGFCPDQGYSLFLVAAHEFGHALGLDHSSVPEALMYPLYSYLEGFPLNKDDIDGIQYLYGRGSKPDPRPPATTTTEPQPTAPPTMCPTIPPTAYPTVGPTVGPTGAPSPGPTSSPSPGPTGAPSPGPTAPPTAGSSEASTESLSPADNPCNVDVFDAIAEIQGALHFFKDGWYWKFLNHRGSPLQGPFLTARTWPALPATLDSAFEDPQTKRVFFFSGRQMWVYTGKTVLGPRSLDKLGLGPEVTHVSGLLPRRLGKALLFSKGRVWRFDLKSQKVDPQSVIRVDKEFSGVPWNSHDIFQYQDKAYFCHGKFFWRVSFQNEVNKVDHEVNQVDDVGYVTYDLLQCP
  
Inhibitor
Name:
BDBM50116280
Synonyms:
CHEMBL73117 | N-(2-Aminomethyl-3H-benzoimidazol-5-yl)-N-(2-benzyloxy-benzyl)-acetamide
Type:
Small organic molecule
Emp. Form.:
C24H24N4O2
Mol. Mass.:
400.473
SMILES:
CC(=O)N(Cc1ccccc1OCc1ccccc1)c1ccc2nc(CN)[nH]c2c1
Structure:
Search PDB for entries with ligand similarity: