BDBM50567712 CHEMBL4869433

SMILES Nc1cc(Cc2ccn(n2)-c2ccc(F)cc2)c2nn[nH]c2n1

InChI Key InChIKey=QWWPDSBUPCYHSK-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50567712   

TargetMyeloperoxidase(Human)
Bristol-Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50567712(CHEMBL4869433)
Affinity DataIC50: 53nMAssay Description:Inhibition of MPO (unknown origin) chlorination activity incubated for 10 mins followed by NaCl addition by aminophenyl fluorescein assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetThyroid peroxidase(Human)
Bristol-Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50567712(CHEMBL4869433)
Affinity DataIC50: 700nMAssay Description:Inhibition of C-terminal hexaHis-tagged TPO (unknown origin) expressed in Trichoplusia ni insect cells using 3-iodo tyrosine as substrate preincubate...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Bristol-Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50567712(CHEMBL4869433)
Affinity DataIC50: 110nMAssay Description:Time dependent inhibition of CYP3A4 (unknown origin) measured at 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed