BDBM479369 ALP-POS-c59291d4-3::CVD-0006352::ML300-based SC inhibitor 1::acs.jmedchem.1c00409_ST.352

SMILES O=C(Cn1nnc2ccccc12)N(Cc1ccsc1)c1ccc(NC(=O)C2CC2)cc1

InChI Key InChIKey=OCKMJWOFMCSMEX-UHFFFAOYSA-N

Data  7 IC50  2 EC50

PDB links: 2 PDB IDs match this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 479369   

TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  2.84E+4nMAssay Description:The assay was performed according to the published procedure. Briefly, compounds were seeded into assay-ready plates (Greiner 384PP, cat# 781280) usi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails PDB3D3D Structure (crystal)
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  3.99E+3nMAssay Description:Compounds were seeded into assay-ready plates (Greiner 384 low volume, cat 784900) using an Echo 555 acoustic dispenser, and DMSO was back-filled for...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails PDB3D3D Structure (crystal)
TargetSerine protease 1(Homo sapiens (Human))
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  9.90E+4nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails
TargetReplicase polyprotein 1ab(Human SARS coronavirus (SARS-CoV) (Severe acute re...)
Cleveland Clinic

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  4.45E+3nMAssay Description:The protease activity and subsequent 10-point IC50 curves were spectroscopically determined using a scaled down, end point assay adapted from a previ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  3.99E+3nMAssay Description:Compounds were seeded into assay-ready plates (Greiner 384 low volume, cat. no. 784900) using an Echo 555 acoustic dispenser, and dimethyl sulfoxide ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataEC50:  1.99E+4nMAssay Description:Briefly, Vero E6 ACE2 cells were cultured in 96-well flat-bottom plates at a density of 2 × 104 cells per well. Following infection of the cells with...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataEC50:  2.82E+4nMAssay Description:Confluent monolayers of Vero E6 ACE2 cells in 12-well plates were washed once with DMEM and infected with approximately 50 plaque forming units (PFUs...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetReplicase polyprotein 1ab(Human SARS coronavirus (SARS-CoV) (Severe acute re...)
Cleveland Clinic

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  4.10E+3nMAssay Description:This is a review article. Please point to the original journal.More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM479369(ALP-POS-c59291d4-3 | CVD-0006352 | ML300-based SC ...)
Affinity DataIC50:  4.99E+3nMAssay Description:The protease activity and subsequent 10-point IC50 curves were spectroscopically determined using a scaled down, end point assay adapted from a previ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB