BDBM801095 US12590092, Compound IE1963-113a

SMILES CC(C)C(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)OC(C(=O)O)=C[C@@H]1n1nnc2ccc3[nH]ccc3c21

InChI Key InChIKey=KEEWRJQSXBQLES-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 801095   

TargetHemagglutinin-neuraminidase(Human respirovirus 3 (HPIV-3))
Griffith University

US Patent
LigandChemical structure of BindingDB Monomer ID 801095BDBM801095(US12590092, Compound IE1963-113a)
Affinity DataIC50: 6.33E+3nMAssay Description:Purified hPIV-3 or hPIV-1, inhibitors and MUN were prepared and diluted in NA Reaction Buffer [NaOAc 50 mM, CaCI2 5 mM, pH 4.6 (hPIV-3) or 5.0 (hPIV-...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
8/10/2026
Entry Details
US Patent

TargetNicotinamide phosphoribosyltransferase(Human)
Griffith University

US Patent
LigandChemical structure of BindingDB Monomer ID 801095BDBM801095(US12590092, Compound IE1963-113a)
Affinity DataIC50: 1.70E+4nMAssay Description:Purified hPIV-3 or hPIV-1, inhibitors and MUN were prepared and diluted in NA Reaction Buffer [NaOAc 50 mM, CaCI2 5 mM, pH 4.6 (hPIV-3) or 5.0 (hPIV-...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
8/10/2026
Entry Details
US Patent

TargetHemagglutinin-neuraminidase(Human respirovirus 1 (HPIV-1))
Griffith University

US Patent
LigandChemical structure of BindingDB Monomer ID 801095BDBM801095(US12590092, Compound IE1963-113a)
Affinity DataIC50: 3.49E+4nMAssay Description:Purified hPIV-3 or hPIV-1, inhibitors and MUN were prepared and diluted in NA Reaction Buffer [NaOAc 50 mM, CaCI2 5 mM, pH 4.6 (hPIV-3) or 5.0 (hPIV-...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
8/10/2026
Entry Details
US Patent