Reaction Details
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Alkaline phosphatase, tissue-nonspecific isozyme
Ligand
BDBM82053
Substrate
n/a
Meas. Tech.
ChEMBL_1782193 (CHEMBL4253710)
IC50
>100000±n/a nM
Citation
Jafari, B; Ospanov, M; Ejaz, SA; Yelibayeva, N; Khan, SU; Amjad, ST; Safarov, S; Abilov, ZA; Turmukhanova, MZ; Kalugin, SN; Ehlers, P; Lecka, J; Sévigny, J; Iqbal, J; Langer, P 2-Substituted 7-trifluoromethyl-thiadiazolopyrimidones as alkaline phosphatase inhibitors. Synthesis, structure activity relationship and molecular docking study. Eur J Med Chem 144:116-127 (2018) [PubMed] Article More Info.:
Target
Name:
Alkaline phosphatase, tissue-nonspecific isozyme
Synonyms:
ALPL | PPBT_HUMAN | tissue-nonspecific alkaline phosphatase precursor
Type:
PROTEIN
Mol. Mass.:
57306.17
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1448917
Residue:
524
Sequence:
MISPFLVLAIGTCLTNSLVPEKEKDPKYWRDQAQETLKYALELQKLNTNVAKNVIMFLGDGMGVSTVTAARILKGQLHHNPGEETRLEMDKFPFVALSKTYNTNAQVPDSAGTATAYLCGVKANEGTVGVSAATERSRCNTTQGNEVTSILRWAKDAGKSVGIVTTTRVNHATPSAAYAHSADRDWYSDNEMPPEALSQGCKDIAYQLMHNIRDIDVIMGGGRKYMYPKNKTDVEYESDEKARGTRLDGLDLVDTWKSFKPRYKHSHFIWNRTELLTLDPHNVDYLLGLFEPGDMQYELNRNNVTDPSLSEMVVVAIQILRKNPKGFFLLVEGGRIDHGHHEGKAKQALHEAVEMDRAIGQAGSLTSSEDTLTVVTADHSHVFTFGGYTPRGNSIFGLAPMLSDTDKKPFTAILYGNGPGYKVVGGERENVSMVDYAHNNYQAQSAVPLRHETHGGEDVAVFSKGPMAHLLHGVHEQNYVPHVMAYAACIGANLGHCAPASSAGSLAAGPLLLALALYPLSVLF
Inhibitor
Name:
BDBM82053
Synonyms:
8-(2-Furyl)theophylline | US9138393, Theophylline | US9144538, Theophylline
Type:
n/a
Emp. Form.:
C7H8N4O2
Mol. Mass.:
180.164
SMILES:
Cn1c2[nH]cnc2c(=O)n(C)c1=O
Structure:
