Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL46403

STEARIC ACID
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCCCCCCCCCCCCCCCCC(=O)O

Basic Information

ChEMBL ID CHEMBL46403
Name STEARIC ACID
Phase Preclinical
Structure Type MOL
InChI Key QIQXTHQIDYTFRH-UHFFFAOYSA-N

Known Names

Adeka sa 300 Barolub fta Century 1210 Dervacid 3155 E570 Edenor htict-n Fatty acids, hydrogenated tallow FEMA NO. 3035 Hydrofol acid 150 Hydrogenated tallow acid Hydrogenated tallow acid, beef Hydrogenated tallow acids +18 more
6
Targets
10
Activities
4
Assay Types
0
PK Parameters
20
Publications
30
Known Names

Molecular Properties

284.5
MW (Da)
6.33
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.34
QED
1
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product

Extended Properties

Molecular Formula C18H36O2
MW 284.48
Aromatic Rings 0
Heavy Atoms 20
NP-Likeness 0.35

Activity Summary

IC50 6 meas. best 5.96
Ki 2 meas. best 5.44
EC50 1 meas. best 4.4
Kd 1 meas. best 4.1

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Peroxisome proliferator-activated receptor alpha
CHEMBL239
IC50 5.96 5.96 1100.0 1
Tyrosine-protein phosphatase non-receptor type 1
CHEMBL335
IC50 5.64 5.64 2300.0 1
Acetylcholinesterase
CHEMBL4078
Ki 5.44 5.4 3620.0 2
Peroxisome proliferator-activated receptor delta
CHEMBL3979
IC50 5.22 5.22 6000.0 1
Acetylcholinesterase
CHEMBL4078
IC50 5.12 5.12 7500.0 1
Peroxisome proliferator-activated receptor gamma
CHEMBL235
IC50 4.52 4.52 30000.0 1
Peroxisome proliferator-activated receptor alpha
CHEMBL239
EC50 4.4 4.4 40000.0 1
Fatty acid-binding protein, adipocyte
CHEMBL2083
Kd 4.1 4.1 80000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
21780738 10.1021/jf201611b Heterodera zeae 33
22459211 10.1016/j.bmc.2012.02.039 Unchecked 7
21903399 10.1016/j.bmc.2011.08.023 Unchecked 4
30220607 10.1016/j.bmcl.2018.09.013 Acetylcholinesterase 4
35089724 10.1021/acs.jmedchem.1c01542 Peroxisome proliferator-activated receptor alpha 3
21903399 10.1016/j.bmc.2011.08.023 RAW264.7 3
21903399 10.1016/j.bmc.2011.08.023 DNA polymerase kappa 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
31046273 10.1021/acs.jnatprod.8b00890 Trypanosoma cruzi 2
20405849 10.1021/jm100190c HT-29 2
3398003 10.1021/jm00403a029 Crithidia fasciculata 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 2
21493076 10.1016/j.bmc.2011.03.036 Staphylococcus aureus 2
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 2
21903399 10.1016/j.bmc.2011.08.023 DNA polymerase lambda 2
20405849 10.1021/jm100190c COLO 205 1
- 10.1021/np50061a020 3-hydroxy-3-methylglutaryl-coenzyme A reductase 1
11421736 10.1021/np000620d Prostaglandin G/H synthase 1 1

Data from ChEMBL 36 via Core Engine