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Target
Thermolysin
Ligand
BDBM50274869
Substrate
n/a
Meas. Tech.
ChEMBL_494286 (CHEMBL938618)
IC50
47000±n/a nM
Citation
 Khan, MT; Fuskevåg, OM; Sylte, I Discovery of potent thermolysin inhibitors using structure based virtual screening and binding assays. J Med Chem 52:48-61 (2009) [PubMed]  Article 
Target
Name:
Thermolysin
Synonyms:
THER_BACTH | npr
Type:
PROTEIN
Mol. Mass.:
60097.54
Organism:
Bacillus thermoproteolyticus
Description:
ChEMBL_1468794
Residue:
548
Sequence:
MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK
  
Inhibitor
Name:
BDBM50274869
Synonyms:
CHEMBL464808 | N-(2-chloro-6-methylphenyl)-2-hydroxy-3-nitrobenzamide
Type:
Small organic molecule
Emp. Form.:
C14H11ClN2O4
Mol. Mass.:
306.701
SMILES:
Cc1cccc(Cl)c1NC(=O)c1cccc(c1O)[N+]([O-])=O
Structure:
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