Compound Detail
CHEMBL437765
RIFAMYCIN 💊 Approved Drug
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💊 Approved Drug
CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(cc(O)c4c3C2=O)NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C
Basic Information
| ChEMBL ID | CHEMBL437765 |
| Name | RIFAMYCIN |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | HJYYPODYNSCCOU-ODRIEIDWSA-N |
| Therapeutic | ✓ Yes |
14
Targets
23
Activities
3
Assay Types
5
PK Parameters
20
Publications
8
Known Names
5
Indications
Molecular Properties
697.8
MW (Da)
4.75
ALogP
12
HBA
6
HBD
201.3
PSA (Ų)
0.14
QED
3
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 2018 |
| Availability | Prescription |
| Chirality | Single Enantiomer |
Indications
Eye Infections Tuberculosis Diarrhea Dysentery Irritable Bowel Syndrome
ATC Classification
A07AA13
rifamycin
Level 1: ALIMENTARY TRACT AND METABOLISM
Level 2: ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
D06AX15
rifamycin
Level 1: DERMATOLOGICALS
Level 2: ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
J04AB03
rifamycin
Level 1: ANTIINFECTIVES FOR SYSTEMIC USE
Level 2: ANTIMYCOBACTERIALS
S01AA16
rifamycin
Level 1: SENSORY ORGANS
Level 2: OPHTHALMOLOGICALS
S02AA12
rifamycin
Level 1: SENSORY ORGANS
Level 2: OTOLOGICALS
Activity Summary
IC50 14 meas. best 8.07
Ki 8 meas. best 5.7
Kd 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.07 | 6.285 | 8.6 | 2 |
| Solute carrier organic anion transporter family member 1B1 CHEMBL1697668 | IC50 | 6.64 | 6.64 | 230.0 | 1 |
| Plasmodium falciparum CHEMBL364 | IC50 | 6.26 | 6.26 | 550.0 | 1 |
| Trypanosoma brucei rhodesiense CHEMBL612348 | IC50 | 6.0 | 6.0 | 990.0 | 1 |
| Leishmania donovani CHEMBL367 | IC50 | 5.82 | 5.82 | 1500.0 | 1 |
| Solute carrier organic anion transporter family member 1B1 CHEMBL1697668 | Ki | 5.7 | 5.7 | 2000.0 | 1 |
| Solute carrier organic anion transporter family member 2B1 CHEMBL1743124 | Ki | 5.52 | 5.52 | 3000.0 | 1 |
| Solute carrier organic anion transporter family member 1B3 CHEMBL1743121 | Ki | 5.52 | 5.52 | 3000.0 | 1 |
| Bile salt export pump CHEMBL2073674 | IC50 | 5.51 | 5.51 | 3100.0 | 1 |
| Bile salt export pump CHEMBL2073674 | Ki | 5.42 | 5.42 | 3800.0 | 1 |
| Bile salt export pump CHEMBL6020 | IC50 | 5.2 | 5.0433 | 6300.0 | 3 |
| Solute carrier organic anion transporter family member 1A1 CHEMBL1781859 | Ki | 5.18 | 5.18 | 6600.0 | 1 |
| Solute carrier organic anion transporter family member 1A4 CHEMBL1781860 | Ki | 5.14 | 5.14 | 7300.0 | 1 |
| Solute carrier organic anion transporter family member 1A2 CHEMBL1743123 | Ki | 4.96 | 4.96 | 11000.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.8 | 4.59 | 15680.0 | 2 |
| Bile salt export pump CHEMBL6020 | Ki | 4.51 | 4.51 | 31000.0 | 1 |
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.3 | 4.3 | 49950.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 80.0 | mL.min-1.kg-1 | - |
| CL | 3.0 | uL.min-1.(10^6cells)-1 | Rattus norvegicus |
| Cmax | 2780.0 | nM | Homo sapiens |
| T1/2 | 0.33 | hr | - |
| Vd | 1.2 | L.kg-1 | - |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine