Compound Detail
CHEMBL2146063
CHLORTETRACYCLINE HYDROCHLORIDE 💊 Approved Drug
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💊 Approved Drug
CN(C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@@H]12.Cl
Basic Information
| ChEMBL ID | CHEMBL2146063 |
| Name | CHLORTETRACYCLINE HYDROCHLORIDE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | CBHYYLPALVVVEY-MRFRVZCGSA-N |
| Therapeutic | ✓ Yes |
| Parent Compound | CHEMBL404520 |
| Active Moiety | CHEMBL404520 |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
17
Publications
10
Known Names
1
Mechanisms
Molecular Properties
478.9
MW (Da)
0.44
ALogP
9
HBA
6
HBD
181.6
PSA (Ų)
0.33
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1950 |
| Availability | Discontinued |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Bacterial 70S ribosome inhibitor | INHIBITOR | Bacterial 70S ribosome | ✓ | ✓ |
Activity Summary
EC50 2 meas. best 7.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptokinase A CHEMBL1293228 | EC50 | 7.19 | 7.19 | 65.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 6.83 | 6.83 | 148.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptokinase A | EC50 | = | 65.0 | nM | 7.19 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 148.0 | nM | 6.83 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4296183 | Acinetobacter baumannii | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.1101/2020.04.03.023846 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4296183 | Candida albicans | 1 |
| - | 10.6019/CHEMBL4296183 | Klebsiella pneumoniae | 1 |
| - | 10.6019/CHEMBL4296183 | HEK293 | 1 |
| - | 10.6019/CHEMBL4296183 | Cryptococcus neoformans | 1 |
| 20553011 | 10.1021/tx1000865 | Hepatotoxicity | 1 |
| - | 10.6019/CHEMBL4296183 | Pseudomonas aeruginosa | 1 |
| - | 10.6019/CHEMBL4296183 | Escherichia coli | 1 |
| - | 10.6019/CHEMBL4296183 | Staphylococcus aureus | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
| 22194678 | 10.1371/journal.pcbi.1002310 | Hepatotoxicity | 1 |
| 20843939 | 10.1124/dmd.110.035113 | Hepatotoxicity | 1 |
Data from ChEMBL 36 via Core Engine