BDBM525203 N-[(1S)-1-[[(2-Chloroacetyl)-[(2-oxo-pyrrolidin-3-yl)methyl]amino]carbamoyl]-3-methyl-butyl]-1H-indole-2-carboxamide::WO2022043374, Example 51-A

SMILES CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)NN(C[C@H]1CCNC1=O)C(=O)CCl

InChI Key InChIKey=UAFLFCJAOKBHAW-UHFFFAOYSA-N

Data  6 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 6 hits for monomerid = 525203   

TargetReplicase polyprotein 1ab(2019-nCoV)
F. Hoffmann-La Roche

WIPO
LigandPNGBDBM525203(WO2022043374, Example 51-A | N-[(1S)-1-[[(2-Chloro...)
Affinity DataIC50: 40nMAssay Description:For the SARS-CoV-2 3CLpro assay, 2 μL of 0.02 μM recombinant SARS-CoV-2 3CL protease were mixed with serial dilutions of each c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2022
Entry Details
WIPO WO2022043374

TargetReplicase polyprotein 1ab(HCoV-229E)
F. Hoffmann-La Roche

WIPO
LigandPNGBDBM525203(WO2022043374, Example 51-A | N-[(1S)-1-[[(2-Chloro...)
Affinity DataIC50: 17nMAssay Description:For the HCoV-229E 3CLpro assay, 2 μL of 0.02 μM recombinant HCoV-229E 3CL protease were mixed with serial dilutions of each com...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2022
Entry Details
WIPO WO2022043374

TargetOrf1a protein(MERS-CoV)
F. Hoffmann-La Roche

WIPO
LigandPNGBDBM525203(WO2022043374, Example 51-A | N-[(1S)-1-[[(2-Chloro...)
Affinity DataIC50: 60nMAssay Description:For the MERS-CoV 3CLpro assay, 2 μL of 0.02 μM recombinant MERS-CoV 3CL protease were mixed with serial dilutions of each compo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2022
Entry Details
WIPO WO2022043374

TargetReplicase polyprotein 1ab(HCoV-OC43)
F. Hoffmann-La Roche

WIPO
LigandPNGBDBM525203(WO2022043374, Example 51-A | N-[(1S)-1-[[(2-Chloro...)
Affinity DataIC50: 19nMAssay Description: For the HCoV-OC433CLpro assay, 2 μL of 0.02 μM recombinant HCoV-OC433CL protease were mixed with serial dilutions of each comp...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2022
Entry Details
WIPO WO2022043374

TargetReplicase polyprotein 1ab(SARS-CoV)
F. Hoffmann-La Roche

WIPO
LigandPNGBDBM525203(WO2022043374, Example 51-A | N-[(1S)-1-[[(2-Chloro...)
Affinity DataIC50: 15nMAssay Description:For the SARS-CoV 3CLpro assay, 2 μL of 0.02 μM recombinant SARS-CoV 3CL protease were mixed with serial dilutions of each compo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2022
Entry Details
WIPO WO2022043374

TargetReplicase polyprotein 1ab(2019-nCoV)
F. Hoffmann-La Roche

WIPO
LigandPNGBDBM525203(WO2022043374, Example 51-A | N-[(1S)-1-[[(2-Chloro...)
Affinity DataIC50: 3nMAssay Description:Inhibition of recombinant SARS-CoV-2 3CLpro expressed in Escherichia coli BL21 DE3 using FAM-KTSAVLQSGFRKMEK-TAMRA fluorogenic peptide as substrate p...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed