BDBM787217 US12473262, Compound 587

SMILES O=C(c1ccc(F)cc1)n1c(-c2cccc3ccccc23)nc2ccc(Cl)cc21

InChI Key InChIKey=KLQTWJFMOPZWII-UHFFFAOYSA-N

  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 7 hits for monomerid = 787217   

TargetCytochrome P450 1A2(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent

TargetCytochrome P450 2C8(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 3.20E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent

TargetCytochrome P450 2C9(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 5.30E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 6.30E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent

TargetCytochrome P450 2C19(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 6.70E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent

TargetCytochrome P450 2B6(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 1.16E+4nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent

TargetCytochrome P450 2D6(Human)
Oregon State University

US Patent
LigandChemical structure of BindingDB Monomer ID 787217BDBM787217(US12473262, Compound 587)
Affinity DataIC50: 2.60E+4nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
3/8/2026
Entry Details
US Patent