BDBM106345 US8575197, II-258

SMILES COc1ccccc1C1c2c(n[nH]c2C(C)(CO)CO)C(=O)N1c1ccc(-c2ccon2)cc1

InChI Key InChIKey=JUOGKKFFOPMFTH-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 106345   

TargetP2X purinoceptor 3(Human)
Shionogi

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 106345BDBM106345(US8575197, II-258)
Affinity DataIC50: 304nMAssay Description:Antagonist activity at human P2X3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2022
Entry Details Article
PubMed
TargetP2X purinoceptor 3(Human)
Shionogi

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 106345BDBM106345(US8575197, II-258)
Affinity DataIC50: 304nMAssay Description:Inhibition assay using human P2X3 receptor gene (GeneBank accession number Y07683).More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2014
Entry Details
US Patent

TargetCytochrome P450 2C9(Human)
Shionogi

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 106345BDBM106345(US8575197, II-258)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP2C9 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2022
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Shionogi

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 106345BDBM106345(US8575197, II-258)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP1A2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2022
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Shionogi

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 106345BDBM106345(US8575197, II-258)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2022
Entry Details Article
PubMed