Compound Detail
CHEMBL322241
TELINAVIR 🧪 Phase II
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🧪 Phase II
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1)C(=O)NC(C)(C)C
Basic Information
| ChEMBL ID | CHEMBL322241 |
| Name | TELINAVIR |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | ZILOOGIOHVCEKS-HZFUHODCSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
5
Publications
3
Known Names
1
Indications
1
Mechanisms
Molecular Properties
604.8
MW (Da)
2.76
ALogP
6
HBA
5
HBD
166.8
PSA (Ų)
0.20
QED
1
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Human immunodeficiency virus type 1 protease inhibitor | INHIBITOR | Human immunodeficiency virus type 1 protease | ✓ | ✓ |
Indications
HIV Infections
Activity Summary
IC50 2 meas. best 8.22
EC50 1 meas. best 7.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 protease CHEMBL243 | IC50 | 8.22 | 8.22 | 6.0 | 1 |
| Protease CHEMBL2366517 | IC50 | 8.2 | 8.2 | 6.3 | 1 |
| Human rhinovirus A protease CHEMBL2857 | EC50 | 7.68 | 7.68 | 21.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 protease | IC50 | = | 6.0 | nM | 8.22 | Inhibition of HIV-1 Protease. | 8423599 |
| Protease | IC50 | = | 6.3 | nM | 8.2 | Inhibition of HIV-1 protease by spectrofluorometric assay | 31789518 |
| Human rhinovirus A protease | EC50 | = | 21.0 | nM | 7.68 | Effective concentration necessary to inhibit 50% HIV-induced cell death. | 8423599 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| 8423599 | 10.1021/jm00054a014 | Human immunodeficiency virus type 1 protease | 1 |
| 8423599 | 10.1021/jm00054a014 | Human rhinovirus A protease | 1 |
| 8423599 | 10.1021/jm00054a014 | Human immunodeficiency virus 1 | 1 |
| 31789518 | 10.1021/acs.jmedchem.9b01541 | Protease | 1 |
Data from ChEMBL 36 via Core Engine