Compound Detail
CHEMBL1201195
CEFMETAZOLE 💊 Approved Drug
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💊 Approved Drug
CO[C@@]1(NC(=O)CSCC#N)C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@@H]21
Basic Information
| ChEMBL ID | CHEMBL1201195 |
| Name | CEFMETAZOLE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | SNBUBQHDYVFSQF-HIFRSBDPSA-N |
| Therapeutic | ✓ Yes |
1
Targets
7
Activities
2
Assay Types
11
PK Parameters
20
Publications
3
Known Names
3
Indications
Molecular Properties
471.6
MW (Da)
-0.73
ALogP
12
HBA
2
HBD
163.3
PSA (Ų)
0.20
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1989 |
| Availability | Discontinued |
| Chirality | Single Enantiomer |
Indications
Bacterial Infections Colorectal Neoplasms Osteomyelitis
ATC Classification
J01DC09
cefmetazole
Level 1: ANTIINFECTIVES FOR SYSTEMIC USE
Level 2: ANTIBACTERIALS FOR SYSTEMIC USE
Activity Summary
Ki 5 meas.
IC50 2 meas. best 5.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Insulin-degrading enzyme CHEMBL1293287 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 40.0 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 1.5 | mL.min-1.kg-1 | Homo sapiens |
| CL | 1.8 | mL.min-1.kg-1 | Homo sapiens |
| CL | 3.8 | mL.min-1.kg-1 | Macaca |
| CL | 5.3 | mL.min-1.kg-1 | Canis lupus familiaris |
| CL | 6.217 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 3.567 | mL.min-1.kg-1 | Rattus norvegicus |
| Fu | 0.15 | - | Homo sapiens |
| Fu | 0.738 | - | Rattus norvegicus |
| MRT | 1.5 | hr | Homo sapiens |
| T1/2 | 1.5 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Insulin-degrading enzyme | IC50 | = | 7000.0 | nM | 5.16 | Inhibition of human recombinant IDE expressed in Escherichia coli BL21 (DE3) cel... | 31276900 |
Literature References
Data from ChEMBL 36 via Core Engine