BDBM775098 US20250304587, Compound 44

SMILES C=CCn1c(=O)c2cnc(Nc3ccc(N4CCC5(CCN(C)CC5)CC4)cc3)nc2n1-c1ccc2c(n1)[C@](C)(O)C1(CC2)CC1

InChI Key

  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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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 775098   

TargetCytochrome P450 2C19(Human)
Jiangsu Tasly Diyi Pharmaceutical Co.

US Patent
LigandPNGBDBM775098(US20250304587, Compound 44)
Affinity DataIC50: 5.50E+3nMAssay Description:Enzymatic experiments were performed to quantify the inhibition of CYP450 enzyme activity of each isoform of CYP450 by small molecule inhibitors thro...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent

TargetCytochrome P450 2C9(Human)
Jiangsu Tasly Diyi Pharmaceutical Co.

US Patent
LigandPNGBDBM775098(US20250304587, Compound 44)
Affinity DataIC50: 1.00E+4nMAssay Description:Enzymatic experiments were performed to quantify the inhibition of CYP450 enzyme activity of each isoform of CYP450 by small molecule inhibitors thro...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent

TargetCytochrome P450 1A2(Human)
Jiangsu Tasly Diyi Pharmaceutical Co.

US Patent
LigandPNGBDBM775098(US20250304587, Compound 44)
Affinity DataIC50: 1.00E+4nMAssay Description:Enzymatic experiments were performed to quantify the inhibition of CYP450 enzyme activity of each isoform of CYP450 by small molecule inhibitors thro...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Jiangsu Tasly Diyi Pharmaceutical Co.

US Patent
LigandPNGBDBM775098(US20250304587, Compound 44)
Affinity DataIC50: 1.00E+4nMAssay Description:Enzymatic experiments were performed to quantify the inhibition of CYP450 enzyme activity of each isoform of CYP450 by small molecule inhibitors thro...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent

TargetCytochrome P450 2C8(Human)
Jiangsu Tasly Diyi Pharmaceutical Co.

US Patent
LigandPNGBDBM775098(US20250304587, Compound 44)
Affinity DataIC50: 1.00E+4nMAssay Description:Enzymatic experiments were performed to quantify the inhibition of CYP450 enzyme activity of each isoform of CYP450 by small molecule inhibitors thro...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent

TargetCytochrome P450 2D6(Human)
Jiangsu Tasly Diyi Pharmaceutical Co.

US Patent
LigandPNGBDBM775098(US20250304587, Compound 44)
Affinity DataIC50: 1.00E+4nMAssay Description:Enzymatic experiments were performed to quantify the inhibition of CYP450 enzyme activity of each isoform of CYP450 by small molecule inhibitors thro...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent