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Target
Kallikrein
Ligand
BDBM50004604
Substrate
n/a
Meas. Tech.
ChEBML_92376
Ki
718000±n/a nM
Citation
 Deshpande, MS; Burton, J Mapping the binding site of tissue kallikrein: preparation and testing of all possible substrate analog inhibitors homologous with the sequence of kininogen between Ser386 and Gln392. J Med Chem 35:3094-102 (1992) [PubMed]  Article 
Target
Name:
Kallikrein
Synonyms:
Kallikrein 1
Type:
PROTEIN
Mol. Mass.:
72241.51
Organism:
Sus scrofa
Description:
ChEMBL_92376
Residue:
643
Sequence:
MEVIVLFRIISFRQAVYFMCLFAAVSCGCLPQLHKNTFFRGGDVSAMYTPSARHCQMMCTFHPRCLLFSFLPADSTSVTDKRFGCFLKDSVTGMLPRVLRENAISGHSLKQCGHQIRACHRDIYKGIDMRGVNFNVSKVKTVEECQERCTNSIHCLFFTYATQAFNNAEYRNNCLLKHSPGGTPTSIKVLANVESGFSLKPCADSEIGCHMDIFQHLAFSDVDVARVIAPDAFVCRTICTYHPNCLFFTFYTNAWKIESQRNVCFLKTSHSGTPSFPTPQENAISGYSLLTCKQTLPEPCHSKIYSEVDFEGEELNVTFVQGANLCQETCTKTIRCQFFTYSLHPEDCRGEKCKCSLRLSSDGSPTKITHGMRASSGYSLRLCRSGDHSACATKANTRIVGGTDSFLGEWPWQVSLQAKLRAQNHLCGGSIIGHQWVLTAAHCFDGLSLPDIWRIYGGILNISEITKETPFSQVKEIIIHQNYKILESGHDIALLKLETPLNYTDFQKPICLPSRDDTNVVYTNCWVTGWGFTEEKGEIQNILQKVNIPLVSNEECQKSYRDHKISKQMICAGYKEGGKDACKGESGGPLVCKYNGIWHLVGTTSWGEGCARREQPGVYTKVIEYMDWILEKTQDDDGQSWMK
  
Inhibitor
Name:
BDBM50004604
Synonyms:
2-(2-Acetylamino-3-phenyl-propionylamino)-5-guanidino-pentanoic acid (1-carbamoyl-2-hydroxy-ethyl)-amide | CHEMBL322972
Type:
Small organic molecule
Emp. Form.:
C20H31N7O5
Mol. Mass.:
449.504
SMILES:
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(N)=O
Structure:
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