BDBM50620957 CHEMBL5430978

SMILES CC(C)C[C@@H](O)C(=O)N1CC2(CC2)C[C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)COC(F)(F)F

InChI Key InChIKey=LTCAMZPTBRHGIT-UHFFFAOYSA-N

Data  12 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50620957   

TargetReplicase polyprotein 1ab(2019-nCoV)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 23nMAssay Description:Inhibition of recombinant SARS-CoV-2 3CL protease using Dabcyl-TSAVLQSGFRK-Glu-EDANS fluorogenic peptide as substrate pre-incubated for 30 mins follo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCathepsin K(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 100nMAssay Description:Inhibition of human Cathepsin KMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCathepsin L2(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 200nMAssay Description:Inhibition of human Cathepsin L2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCathepsin S(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 700nMAssay Description:Inhibition of human Cathepsin SMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetProcathepsin L(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 1.60E+3nMAssay Description:Inhibition of human Cathepsin LMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCathepsin B(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 4.30E+3nMAssay Description:Inhibition of human Cathepsin BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human ERG expressed in CHO cells by whole-cell patch clamp assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCytochrome P450 1A2(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsome incubated for 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCytochrome P450 2C9(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsome incubated for 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCytochrome P450 2C19(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP2C19 in human liver microsome incubated for 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCytochrome P450 3A4(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsome incubated for 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCytochrome P450 2D6(Human)
Calibr At Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50620957(CHEMBL5430978)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsome incubated for 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed