BDBM50625640 CHEMBL5394667::US12565480, Compound 3

SMILES OC(=O)c1ccc(cc1O)-c1sc(C#N)c2CCCc12

InChI Key InChIKey=AXFUVKIJAUFLLV-UHFFFAOYSA-N

Data  8 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50625640   

TargetXanthine dehydrogenase/oxidase(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 25.9nMAssay Description:NMDA receptors are ion channels that are highly permeable to Ca2+ ions, rendering it possible to monitor NMDA receptor function using cell-based calc...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/13/2026
Entry Details
US Patent

TargetXanthine dehydrogenase/oxidase(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 26nMAssay Description:Inhibition of XO (unknown origin) using xanthine as substrate by spectrophotometric analysisMore data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/18/2024
Entry Details
PubMed
TargetXanthine dehydrogenase/oxidase(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 4.05E+3nMAssay Description:Inhibition of XO (unknown origin) using xanthine as substrate assessed as decrease in uric acid level by spectrophotometric analysisMore data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/18/2024
Entry Details
PubMed
TargetCytochrome P450 2C9(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 1.48E+4nMAssay Description:NMDA receptors are ion channels that are highly permeable to Ca2+ ions, rendering it possible to monitor NMDA receptor function using cell-based calc...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/13/2026
Entry Details
US Patent

TargetCytochrome P450 1A2(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 5.00E+4nMAssay Description:NMDA receptors are ion channels that are highly permeable to Ca2+ ions, rendering it possible to monitor NMDA receptor function using cell-based calc...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/13/2026
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 5.00E+4nMAssay Description:NMDA receptors are ion channels that are highly permeable to Ca2+ ions, rendering it possible to monitor NMDA receptor function using cell-based calc...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/13/2026
Entry Details
US Patent

TargetCytochrome P450 2D6(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 5.00E+4nMAssay Description:NMDA receptors are ion channels that are highly permeable to Ca2+ ions, rendering it possible to monitor NMDA receptor function using cell-based calc...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/13/2026
Entry Details
US Patent

TargetCytochrome P450 2C19(Human)
Tonghua Dongbao Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 50625640BDBM50625640(CHEMBL5394667 | US12565480, Compound 3)
Affinity DataIC50: 5.00E+4nMAssay Description:NMDA receptors are ion channels that are highly permeable to Ca2+ ions, rendering it possible to monitor NMDA receptor function using cell-based calc...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/13/2026
Entry Details
US Patent