BDBM682655 (S)-N-(4-((1R,3R)-7-ethynyl-3-methyl-2-(2,2,2-trifluoroethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-3,5-difluorophenyl)-1-(3-fluoropropyl)pyrrolidin-3-amine ::US20240208932, Compound 43

SMILES C[C@@H]1Cc2c([nH]c3cc(ccc23)C#C)[C@H](N1CC(F)(F)F)c1c(F)cc(N[C@H]2CCN(CCCF)C2)cc1F

InChI Key InChIKey=GMCBAWJMTUFOII-UHFFFAOYSA-N

Data  5 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
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 682655   

TargetCytochrome P450 1A2(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682655(US20240208932, Compound 43 | (S)-N-(4-((1R,3R)-7-e...)
Affinity DataIC50: 4.16E+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
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TargetCytochrome P450 2C9(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682655(US20240208932, Compound 43 | (S)-N-(4-((1R,3R)-7-e...)
Affinity DataIC50: 4.28E+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
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TargetCytochrome P450 2C19(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682655(US20240208932, Compound 43 | (S)-N-(4-((1R,3R)-7-e...)
Affinity DataIC50: 5.00E+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
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TargetCytochrome P450 2D6(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682655(US20240208932, Compound 43 | (S)-N-(4-((1R,3R)-7-e...)
Affinity DataIC50: 2.15E+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
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TargetCytochrome P450 3A4(Human)
Xizang Haisco Pharmaceutical

US Patent
LigandPNGBDBM682655(US20240208932, Compound 43 | (S)-N-(4-((1R,3R)-7-e...)
Affinity DataIC50: 1.27E+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
Go to US Patent