BDBM419121 3CLpro inhibitor 6a

SMILES CC(C)C[C@@H](NC(=O)OC1CCCCC1)C(=O)N[C@H](CC1CCNC1=O)C(O)S([O-])(=O)=O

InChI Key InChIKey=ORKNIPZHPCWIDI-UHFFFAOYSA-M

Data  3 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 3 hits for monomerid = 419121   

TargetReplicase polyprotein 1a(SARS-CoV)
Wichita State University

LigandPNGBDBM419121(3CLpro inhibitor 6a)
Affinity DataIC50: 3.90E+3nMAssay Description:The expression and purification of the 3CLpro of MERS-CoV and SARS-CoV were performed by a standard method described previously by our lab (11, 19, 2...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Wichita State University

LigandPNGBDBM419121(3CLpro inhibitor 6a)
Affinity DataIC50: 820nMAssay Description:The expression and purification of the 3CLpro of MERS-CoV and SARS-CoV were performed by a standard method described previously by our lab (11, 19, 2...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetOrf1a protein(MERS-CoV)
Wichita State University

LigandPNGBDBM419121(3CLpro inhibitor 6a)
Affinity DataIC50: 350nMAssay Description:The expression and purification of the 3CLpro of MERS-CoV and SARS-CoV were performed by a standard method described previously by our lab (11, 19, 2...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed