Compound Detail
CHEMBL5195364
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Basic Information
| ChEMBL ID | CHEMBL5195364 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JWLXOHUMYJGZPC-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
319.2
MW (Da)
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Replicase polyprotein 1ab CHEMBL4523582 | IC50 | 7.55 | 6.85 | 27.9 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Replicase polyprotein 1ab | IC50 | = | 27.95 | nM | 7.55 | Inhibition of SARS-CoV-2 main protease expressed in Escherichia coli BL21 (DE3) ... | 35620927 |
| Replicase polyprotein 1ab | IC50 | = | 27.95 | nM | 7.55 | Inhibition of SARS-CoV-2 Main protease | 36169610 |
| Replicase polyprotein 1ab | IC50 | = | 260.0 | nM | 6.58 | Inhibition of SARS CoV-2 Main protease using MCA-AVLQSGFR-Lys(DNP)-Lys-NH2 pepti... | 34798775 |
| Replicase polyprotein 1ab | IC50 | = | 1885.0 | nM | 5.72 | Inhibition of SARS-CoV-2 papain-like protease expressed in Escherichia coli BL21... | 35620927 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35620927 | 10.1021/acs.jmedchem.2c00303 | Replicase polyprotein 1ab | 2 |
| 36169610 | 10.1021/acs.jmedchem.2c01005 | Replicase polyprotein 1ab | 1 |
| 34798775 | 10.1021/acs.jmedchem.1c00409 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine