BDBM668002 US20240124434, Compound S6-A

SMILES C[C@H](c1ccc(cc1C(F)(F)F)C(F)(F)F)n1cc(NC(=O)c2cc(on2)-c2ccco2)cn1

InChI Key InChIKey=LMTXUPFJHOIWKY-UHFFFAOYSA-N

Data  7 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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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 668002   

TargetCytochrome P450 1A2(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 1.53E+4nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
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TargetCytochrome P450 2C9(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 7.88E+3nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
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TargetCytochrome P450 2D6(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 2.37E+4nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
Go to US Patent

TargetCytochrome P450 2B6(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 4.18E+3nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
Go to US Patent

TargetCytochrome P450 2C8(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 1.35E+3nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
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TargetCytochrome P450 2C19(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 3.54E+3nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
Go to US Patent

TargetCytochrome P450 3A4(Human)
Altos Labs

US Patent
LigandPNGBDBM668002(US20240124434, Compound S6-A)
Affinity DataIC50: 5.00E+4nMAssay Description:CYP inhibition by test compounds in human liver microsomes (HLM) for seven major CYP450 isoforms CYP1A2, CYP2C9, CYP2D6, CYP2B6, CYP2C8, CYP2C19 and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2024
Entry Details
Go to US Patent