BDBM682654 (S)-N-(3,5-difluoro-4-((1R,3R)-6-fluoro-3-methyl-2-(2,2,2-trifluoroethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)-1-(3-fluoropropyl)pyrrolidin-3-amine ::US20240208932, Compound 18

SMILES C[C@@H]1Cc2c([nH]c3ccc(F)cc23)[C@H](N1CC(F)(F)F)c1c(F)cc(N[C@H]2CCN(CCCF)C2)cc1F

InChI Key InChIKey=BAZVVAJWMSTQMM-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 682654   

TargetCytochrome P450 3A4(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682654(US20240208932, Compound 18 | (S)-N-(3,5-difluoro-4...)
Affinity DataIC50: 1.57E+4nMAssay Description:The purpose of this study was to evaluate the effect of the test compound on the activity of five isoenzymes (CYP1A2, CYP2C9, CYP2C19, CYP2D6 and CYP...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/4/2024
Entry Details
US Patent

TargetCytochrome P450 2C9(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682654(US20240208932, Compound 18 | (S)-N-(3,5-difluoro-4...)
Affinity DataIC50: 2.00E+4nMAssay Description:The purpose of this study was to evaluate the effect of the test compound on the activity of five isoenzymes (CYP1A2, CYP2C9, CYP2C19, CYP2D6 and CYP...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/4/2024
Entry Details
US Patent

TargetCytochrome P450 2D6(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682654(US20240208932, Compound 18 | (S)-N-(3,5-difluoro-4...)
Affinity DataIC50: 3.41E+4nMAssay Description:The purpose of this study was to evaluate the effect of the test compound on the activity of five isoenzymes (CYP1A2, CYP2C9, CYP2C19, CYP2D6 and CYP...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/4/2024
Entry Details
US Patent

TargetCytochrome P450 1A2(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682654(US20240208932, Compound 18 | (S)-N-(3,5-difluoro-4...)
Affinity DataIC50: 1.00E+5nMAssay Description:The purpose of this study was to evaluate the effect of the test compound on the activity of five isoenzymes (CYP1A2, CYP2C9, CYP2C19, CYP2D6 and CYP...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/4/2024
Entry Details
US Patent