BDBM496902 CVD-0018409::PF-07321332::US11351149, Example 13::US11753373, Compound D-1-d::US20230391736, Example PF-07321332::US20240208970, Compound PF-07321332::WO2021250648, Example 13::science.abl4784, 6
SMILES CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)C(F)(F)F)C(=O)N[C@@H](C[C@@H]3CCNC3=O)C#N)C
InChI Key InChIKey=LIENCHBZNNMNKG-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 78 hits for monomerid = 496902
Affinity DataKi: 0.260nMAssay Description:Inhibition of N-terminal hexa-histidine tagged SARS-CoV-2 main protease expressed in Escherichia coli BL21 (DE3) using HiLyte Fluor 488TM-ESATLQSGLRK...More data for this Ligand-Target Pair
Affinity DataIC50: 0.790nMAssay Description:Inhibition of recombinant full length SARS-CoV-2 3CLpro expressed in Escherichia coli using Ac-Abu-Tle-Leu-Gln-MCA as fluorogenic substrate preincuba...More data for this Ligand-Target Pair
Affinity DataIC50: 3nMAssay Description:The proteolytic activity of the main protease, 3CLpro, of SARS-CoV-2 was monitored using a continuous fluorescence resonance energy transfer (FRET) a...More data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Inhibition of SARS-CoV-2 main protease expressed in Escherichia coli using Dabcyl-KTSAVLQSGFRKME-Edans as substrate incubated for 60 mins by FRET bas...More data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Binding affinity to SARS-CoV-2 Main protease assessed as inhibition constantMore data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:The proteolytic activity of the main protease, 3CLpro, of SARS-CoV-2 was monitored using a continuous fluorescence resonance energy transfer (FRET) a...More data for this Ligand-Target Pair
Affinity DataIC50: 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
Affinity DataKi: 3nMAssay Description:Inhibition of SARS-CoV-2 MProMore data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Inhibition of SARS-CoV-2 Main protease using Dabcyl-KTSAVLQSGFRKME-Edans as substrate preincubated for 20 mins followed by substrate addition by FRET...More data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Inhibition of SARS-CoV-2 MPro using Dabcyl-KTSAVLQSGFRKME-Edans as substrate assessed as inhibition constant measured for 10 mins by FRET assayMore data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Binding affinity to SARS-Cov-2 main protease assessed as inhibition constantMore data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Inhibition of recombinant SARS CoV-2 Wuhan-Hu-1 main protease extracted from Escherichia coli using Dabcyl-KTSAVLQSGFRKME-Edans as substrate incubate...More data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Inhibition of SARS CoV-2 main proteaseMore data for this Ligand-Target Pair
Affinity DataKi: 3nMAssay Description:Binding affinity to C-terminal His6-tagged recombinant SARS-CoV-2 MPro assessed as inhibition constantMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of SARS-CoV-2 Main protease using peptide substrate assessed as fluorescence of cleaves substrateMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of SARS-Cov-2 MPro assessed as inhibition constant by FRET assayMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of wild type SARS-CoV-2 main protease expressed in Escherichia coli BL21 (DE3) assessed as inhibition constant using DABCYL-KTSAVLQ1SGFRKM...More data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of SARS CoV-2 MProMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Binding affinity of SARS-Cov-2 M pro expressed in Escherichia coli cells BL21(DE3) assessed as inhibition constant preincubated for 30 mins followed ...More data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of SARS-CoV-2 main protease using Dabcyl-KTSAVLQSGFRKME-Edans as substrate incubated for 20 mins by FRET assayMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of recombinant SARS-CoV-2 Wuhan-Hu-1 main protease expressed in Escherichia coli using Dabcyl-KTSAVLQSGFRKME-Edans as substrate incubated ...More data for this Ligand-Target Pair
Affinity DataIC50: 3.10nMAssay Description:Inhibition of SARS-CoV-2 main protease by FRET analysisMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of N-terminal His6-tagged SARS-CoV2 Wuhan-Hu-1 main protease expressed in Escherichia coli using Dabcyl-KTSAVLQSGFRKME-Edans as substrate ...More data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Binding affinity to SARS-CoV-2 MPro assessed as inhibition constantMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Binding affinity to SARS CoV-2 main protease by FRET assayMore data for this Ligand-Target Pair
Affinity DataKi: 3.10nMAssay Description:Inhibition of SARS-CoV-2 3CL protease assessed as inhibition constantMore data for this Ligand-Target Pair
Affinity DataKi: 3.11nMAssay Description:The respective human coronavirus Mpro in assay buffer (20 mM Tris-HCl, pH 7.3, 100 mM NaCl, 1 mM EDTA, 5 mM TCEP) and 0.1% BSA was added to assay-rea...More data for this Ligand-Target Pair
Affinity DataIC50: 3.60nMAssay Description:Inhibition of SARS CoV-2 MProMore data for this Ligand-Target Pair
Affinity DataKi: 4nMAssay Description:Inhibition of SARS-CoV2 main protease using Dabcyl-Lys-Thr-Ser-Ala-Val-Leu-Gln-Ser-Gly-Phe-Arg-Lys-Met-Glu-EDAN as substrate measured after 60 minsMore data for this Ligand-Target Pair
Affinity DataIC50: 6.30nMAssay Description:Mpro activity was measured according to the manufacturer's protocol (BPS Biosciences, cat #78042-2) in 384-well plates. The included recombinant un-t...More data for this Ligand-Target Pair
Affinity DataIC50: 10nMAssay Description:Inhibition of MPro of SARS CoV-2 BetaCoV/Wuhan/WIV04/2019 preincubated for 30 mins followed by substrate addition measured for 1 hr by FRET assayMore data for this Ligand-Target Pair
Affinity DataIC50: 11nMAssay Description:Inhibition of wild type SARS-CoV-2 main protease expressed in Escherichia coli BL21 (DE3) using DABCYL-KTSAVLQ1SGFRKM-E(EDANS)-NH2 as substrate prein...More data for this Ligand-Target Pair
Affinity DataIC50: 11nMAssay Description:Inhibition of SARS-CoV-2 main protease by FRET assayMore data for this Ligand-Target Pair
Affinity DataIC50: 13nMAssay Description:Inhibition of C-terminal 6-his tagged SARS-CoV-2 main protease expressed in Escherichia coli BL-21-Gold(DE3) cells using DabcylKTSAVLQSGFRKM-(Edan) a...More data for this Ligand-Target Pair
Affinity DataIC50: 13nMAssay Description:Inhibition of SARS-CoV2 main protease using fluorogenic substrate preincubated for 30 mins followed by substrate addition and measured after 4 hrs by...More data for this Ligand-Target Pair
Affinity DataIC50: 14nMAssay Description:Inhibition of SARS CoV-2 main protease preincubated for 30 min followed by substrate addition and measured after 60 mins by fluorescence assayMore data for this Ligand-Target Pair
Affinity DataIC50: 16nMAssay Description:Inhibition of untagged SARS-CoV-2 JPN/TY/WK-521 Main protease using FRET-based UIVT3 as substrate by continuous fluorescence assayMore data for this Ligand-Target Pair
Affinity DataIC50: 19nMAssay Description:Covalent inhibition of SARS-CoV-2 main proteaseMore data for this Ligand-Target Pair
Affinity DataIC50: 19nMAssay Description:Inhibition of SARS-CoV-2 Main proteaseMore data for this Ligand-Target Pair
Affinity DataIC50: 20nMAssay Description:Inhibition of SARS-CoV-1 main protease using DabcylKTSAVLQSGFRKM-(Edan) as substrate preincubated for 30 mins followed by substrate addition and meas...More data for this Ligand-Target Pair
Affinity DataIC50: 28nMAssay 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
Affinity DataIC50: 30nMAssay Description:Inhibition of SARS CoV-2 main proteaseMore data for this Ligand-Target Pair
Affinity DataIC50: 31nMAssay Description:Inhibition of full length SARS-CoV-2 3CLpro expressed in Escherichia coli BL21 (DE3) cells using (DABCYL)KTSAVLQSGFRKM(Glu)(EDANS) peptide as substra...More data for this Ligand-Target Pair
Affinity DataIC50: 35nMAssay Description:Inhibition of recombinant SARS-CoV-2 3CLpro using Dacyl-KTSAVLQSGFRKME-Edans as substrate preincubated for 10 mins followed by substrate addition mea...More data for this Ligand-Target Pair
Affinity DataIC50: 39nMAssay Description:Inhibition of SARS-CoV-2 3CL protease expressed in Escherichia coli BL21 (DE3) Rosetta competent cells using DabcylKNSTLQSGLRKE-Edan as fluorescence ...More data for this Ligand-Target Pair
Affinity DataIC50: 41nMAssay Description:Inhibition of full-length SARS CoV-2 MPro expressed in Escherichia coli BL21(DE3) using Boc-Abu-Tle-Leu-Gln-AMC as substrate incubated for 10 mins by...More data for this Ligand-Target Pair
Affinity DataIC50: 42nMAssay Description:Inhibition of full length SARS-CoV-2 3CL protease expressed in Escherichia coli BL21 (DE3) using Dacyl-KTSAVLQSGFRKME-Edans fluorogenic peptide as su...More data for this Ligand-Target Pair
Affinity DataIC50: 47nMAssay Description:The inhibitory activity of the compounds against SARS-CoV-2 3CLpro was determined by fluorescence resonance energy transfer technique. A suitable amo...More data for this Ligand-Target Pair
Affinity DataIC50: 51nMAssay Description:Inhibition of SARS-CoV-2 3CLProMore data for this Ligand-Target Pair
Affinity DataIC50: 54nMAssay Description:Inhibition of SARS-CoV-2 3CL protease using MCA-AVLQSGFR-Lys(Dnp)-Lys-NH2 fluorogenic peptide as substrate incubated for 30 mins and measured by FRET...More data for this Ligand-Target Pair