BDBM668016 N-(1-(1-(2,4- bis(trifluoromethyl)phenyl)ethyl)- 3-methyl-1H-pyrazol-4-yl)-5- (pyridin-2-yl)-1,3,4-thiadiazole-2- carboxamide::US20240124434, Compound 138

SMILES CC(c1ccc(cc1C(F)(F)F)C(F)(F)F)n1cc(NC(=O)c2nnc(s2)-c2ccccn2)c(C)n1

InChI Key InChIKey=IEFWBKPEAQZWHV-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:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 668016   

TargetCytochrome P450 3A4(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
Affinity DataIC50: 2.40E+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
US Patent

TargetCytochrome P450 2B6(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
Affinity DataIC50: 5.00E+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
US Patent

TargetCytochrome P450 2C9(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
Affinity DataIC50: 1.21E+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
US Patent

TargetCytochrome P450 2C19(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
Affinity DataIC50: 1.50E+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
US Patent

TargetCytochrome P450 1A2(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
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
US Patent

TargetCytochrome P450 2D6(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
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
US Patent

TargetCytochrome P450 2C8(Human)
Altos Labs

US Patent
LigandPNGBDBM668016(US20240124434, Compound 138 | N-(1-(1-(2,4- bis(tr...)
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
US Patent