Reaction Details Report a problem with these data
Target
Purple acid phosphatase
Ligand
BDBM50469088
Substrate
n/a
Meas. Tech.
ChEMBL_1802621 (CHEMBL4274913)
Ki
400000±n/a nM
Citation
 Hussein, WM; Feder, D; Schenk, G; Guddat, LW; McGeary, RP Purple acid phosphatase inhibitors as leads for osteoporosis chemotherapeutics. Eur J Med Chem 157:462-479 (2018) [PubMed]  Article 
Target
Name:
Purple acid phosphatase
Synonyms:
3.1.3.2 | PAP | Purple acid phosphatase
Type:
PROTEIN
Mol. Mass.:
37661.29
Organism:
Phaseolus vulgaris
Description:
ChEMBL_118200
Residue:
331
Sequence:
MAGLGVWLAFIGVCFLNVSALLQRLEHPVKADGSLSLVVIGDWGRKGTYNQSEVSAQMGRVGAKLNIDFVISTGDNFYDDGLSGVDDPAFELSFSKIYTAKSLQKQWYSVLGNHDYRGDVEAQLNTILQKIDPRWICQRSFIVDTEIAEFFFVDTTPFVDKYFLKPKDHTYDWTGVLPRDKYLSKLLKDLEIALKDSTAKWKIVVGHHPVRSIGHHGDTQELIRHLLPILEANDVDMYINGHDHCLEHISSTSSQIQFLTSGGGSKAWKGDHLIKMGKMGQRFTMMDKYLQVWRFKKSIPKLFIMIFLAKFCKLLICPRGYVMCMPYNSLI
  
Inhibitor
Name:
BDBM50469088
Synonyms:
CHEMBL4287988
Type:
Small organic molecule
Emp. Form.:
C11H9NO3S
Mol. Mass.:
235.259
SMILES:
COc1ccc(cc1)-c1nc(cs1)C(O)=O
Structure:
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