BDBM674655 US20240158368, Compound 2

SMILES N#Cc1cc(C(=O)N2CCOCC2)c(N2CC[C@@H](NC(=O)c3cc(=O)[nH]c4c(F)cccc34)C2)c(C(F)(F)F)c1

InChI Key InChIKey=KPYQLMJUGSDJQX-UHFFFAOYSA-N

Data  5 EC50

  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 = 674655   

TargetReplicase polyprotein 1ab(2019-nCoV)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 674655BDBM674655(US20240158368, Compound 2)
Affinity DataEC50:  0.480nMAssay Description:Displacement of [3H]-N-methyl-scopolamine from human muscarinic M3 receptor after 6 hrs by cell based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/3/2026
Entry Details PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 674655BDBM674655(US20240158368, Compound 2)
Affinity DataEC50:  0.480nMAssay Description:SARS-CoV-2 Mpro biochemical assays were performed in 8 μL in 384-well Proxi-Plus plate (PerkinElmer, Waltham, MA USA) at ambient temperature in ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2024
Entry Details
US Patent

TargetOrf1a protein(MERS-CoV)
Abbvie

US Patent
LigandChemical structure of BindingDB Monomer ID 674655BDBM674655(US20240158368, Compound 2)
Affinity DataEC50:  1.35nMAssay Description:SARS-CoV-2 Mpro biochemical assays were performed in 8 μL in 384-well Proxi-Plus plate (PerkinElmer, Waltham, MA USA) at ambient temperature in ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2024
Entry Details
US Patent

TargetReplicase polyprotein 1ab(HCoV-229E)
Abbvie

US Patent
LigandChemical structure of BindingDB Monomer ID 674655BDBM674655(US20240158368, Compound 2)
Affinity DataEC50:  2.01nMAssay Description:SARS-CoV-2 Mpro biochemical assays were performed in 8 μL in 384-well Proxi-Plus plate (PerkinElmer, Waltham, MA USA) at ambient temperature in ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2024
Entry Details
US Patent

TargetReplicase polyprotein 1ab(SARS-CoV)
Abbvie

US Patent
LigandChemical structure of BindingDB Monomer ID 674655BDBM674655(US20240158368, Compound 2)
Affinity DataEC50:  2.24nMAssay Description:SARS-CoV-2 Mpro biochemical assays were performed in 8 μL in 384-well Proxi-Plus plate (PerkinElmer, Waltham, MA USA) at ambient temperature in ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2024
Entry Details
US Patent

TargetReplicase polyprotein 1ab(HCoV-OC43)
Abbvie

US Patent
LigandChemical structure of BindingDB Monomer ID 674655BDBM674655(US20240158368, Compound 2)
Affinity DataEC50:  3.09nMAssay Description:SARS-CoV-2 Mpro biochemical assays were performed in 8 μL in 384-well Proxi-Plus plate (PerkinElmer, Waltham, MA USA) at ambient temperature in ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2024
Entry Details
US Patent