Compound Detail
CHEMBL267476
LINOLEIC ACID 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL267476 |
| Name | LINOLEIC ACID |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | OYHQOLUKZRVURQ-HZJYTTRNSA-N |
19
Targets
43
Activities
4
Assay Types
0
PK Parameters
20
Publications
12
Known Names
5
Indications
Molecular Properties
280.4
MW (Da)
5.88
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.32
QED
1
Ro5 Violations
14
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Obesity Asthma Diabetes Mellitus, Type 2 Neoplasms Breast Neoplasms
Activity Summary
IC50 26 meas. best 6.16
EC50 13 meas. best 6.5
Kd 2 meas. best 8.32
Ki 2 meas. best 5.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | Kd | 8.32 | 8.32 | 4.8 | 1 |
| Free fatty acid receptor 4 CHEMBL5339 | EC50 | 6.5 | 6.5 | 316.2 | 1 |
| Free fatty acid receptor 1 CHEMBL4422 | EC50 | 6.27 | 5.7729 | 540.0 | 7 |
| Aldo-keto reductase family 1 member C3 CHEMBL4681 | IC50 | 6.16 | 6.16 | 690.0 | 2 |
| Fatty acid-binding protein, adipocyte CHEMBL2083 | IC50 | 6.0 | 5.2067 | 1000.0 | 3 |
| Seed linoleate 13S-lipoxygenase-1 CHEMBL4586 | IC50 | 6.0 | 5.2833 | 1000.0 | 3 |
| Fatty acid-binding protein, heart CHEMBL3344 | IC50 | 6.0 | 6.0 | 1000.0 | 3 |
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | IC50 | 5.96 | 5.96 | 1100.0 | 2 |
| Peroxisome proliferator-activated receptor gamma CHEMBL235 | IC50 | 5.21 | 5.21 | 6200.0 | 1 |
| Fatty acid-binding protein, adipocyte CHEMBL2083 | Ki | 5.17 | 5.17 | 6800.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.16 | 5.16 | 6918.3 | 1 |
| Fatty acid-binding protein, heart CHEMBL3344 | Ki | 5.03 | 5.03 | 9300.0 | 1 |
| Peroxisome proliferator-activated receptor delta CHEMBL3979 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
| GPR40-Galpha16 CHEMBL5482994 | EC50 | 5.0 | 5.0 | 10100.0 | 1 |
| Prostaglandin G/H synthase 1 CHEMBL221 | IC50 | 4.89 | 4.89 | 13000.0 | 1 |
| Hepatitis C virus CHEMBL379 | EC50 | 4.7 | 4.7 | 20200.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.57 | 4.4967 | 27000.0 | 3 |
| Coagulation factor VII/tissue factor CHEMBL2095194 | IC50 | 4.39 | 4.39 | 41000.0 | 1 |
| Aromatase CHEMBL1978 | IC50 | 4.32 | 4.32 | 48000.0 | 1 |
| Nuclear receptor subfamily 4 group A member 2 CHEMBL5002 | Kd | 4.3 | 4.3 | 50000.0 | 1 |
| Adenosine receptor A1 CHEMBL318 | IC50 | 4.19 | 4.19 | 65000.0 | 1 |
| Prostaglandin G/H synthase 2 CHEMBL4102 | IC50 | 4.03 | 4.03 | 94000.0 | 1 |
| NAD-dependent protein deacylase sirtuin-6 CHEMBL2163182 | EC50 | 4.0 | 4.0 | 100000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine