Compound Detail
CHEMBL46423
NEVANIMIBE 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL46423 |
| Name | NEVANIMIBE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | PKKNCEXEVUFFFI-UHFFFAOYSA-N |
5
Targets
6
Activities
1
Assay Types
0
PK Parameters
14
Publications
5
Known Names
1
Mechanisms
Molecular Properties
421.6
MW (Da)
6.63
ALogP
2
HBA
2
HBD
44.4
PSA (Ų)
0.53
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Acyl coenzyme A:cholesterol acyltransferase 1 inhibitor | INHIBITOR | Sterol O-acyltransferase 1 | ✓ | ✓ |
Activity Summary
IC50 6 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sterol O-acyltransferase 1 CHEMBL2782 | IC50 | 8.05 | 8.05 | 9.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 7.43 | 7.43 | 37.0 | 1 |
| Acyl-CoA:cholesterol acyltransferase CHEMBL6141 | IC50 | 7.43 | 7.355 | 37.0 | 2 |
| Acetyl-CoA acetyltransferase, mitochondrial CHEMBL2616 | IC50 | 6.74 | 6.74 | 183.0 | 1 |
| Sterol O-acyltransferase 2 CHEMBL4465 | IC50 | 6.43 | 6.43 | 368.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sterol O-acyltransferase 1 | IC50 | = | 9.0 | nM | 8.05 | Inhibition of human SOAT1 expressed in mouse AC29 cells | 36473091 |
| Acyl-CoA:cholesterol acyltransferase | IC50 | = | 37.0 | nM | 7.43 | Tested for in vitro inhibition against Acyl coenzyme A:cholesterol acyltransfera... | 8201599 |
| Unchecked | IC50 | = | 37.0 | nM | 7.43 | Inhibition of small intimal microsomal fraction of cholesterol-fed rabbit ACAT u... | 36473091 |
| Acyl-CoA:cholesterol acyltransferase | IC50 | = | 52.0 | nM | 7.28 | In vitro inhibitory activity against ACAT was determined in rabbit intestinal mi... | - |
| Acetyl-CoA acetyltransferase, mitochondrial | IC50 | = | 183.0 | nM | 6.74 | Inhibition of ACAT1 (unknown origin) | 38569434 |
| Sterol O-acyltransferase 2 | IC50 | = | 368.0 | nM | 6.43 | Inhibition of human SOAT2 expressed in mouse AC29 cells | 36473091 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8201599 | 10.1021/jm00037a016 | No relevant target | 6 |
| 8021920 | 10.1021/jm00038a010 | Rattus norvegicus | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.1016/0960-894X(95)00387-9 | Acyl-CoA:cholesterol acyltransferase | 1 |
| - | 10.1016/0960-894X(95)00387-9 | Rattus norvegicus | 1 |
| 8021920 | 10.1021/jm00038a010 | No relevant target | 1 |
| 8201599 | 10.1021/jm00037a016 | Acyl-CoA:cholesterol acyltransferase | 1 |
| 8201599 | 10.1021/jm00037a016 | Rattus norvegicus | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
| 36473091 | 10.1021/acs.jmedchem.2c01265 | Unchecked | 1 |
| 36473091 | 10.1021/acs.jmedchem.2c01265 | Rattus norvegicus | 1 |
| 36473091 | 10.1021/acs.jmedchem.2c01265 | Sterol O-acyltransferase 1 | 1 |
| 36473091 | 10.1021/acs.jmedchem.2c01265 | Sterol O-acyltransferase 2 | 1 |
| 38569434 | 10.1016/j.ejmech.2024.116333 | Acetyl-CoA acetyltransferase, mitochondrial | 1 |
Data from ChEMBL 36 via Core Engine