Serinolamide D
| Internal ID | 35ab522d-9c9a-4bb4-95e2-fb38885228f8 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Carboxylic acid derivatives > Carboxylic acid esters |
| IUPAC Name | [(2R)-3-methoxy-2-[[(E)-2-methylhexadec-2-enoyl]amino]propyl] acetate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C23H43NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20(2)23(26)24-22(18-27-4)19-28-21(3)25/h17,22H,5-16,18-19H2,1-4H3,(H,24,26)/b20-17+/t22-/m1/s1 |
| InChI Key | FPCGSXVPELFJGR-YMQJMOIJSA-N |
| Popularity | 4 references in papers |
| Molecular Formula | C23H43NO4 |
| Molecular Weight | 397.60 g/mol |
| Exact Mass | 397.31920885 g/mol |
| Topological Polar Surface Area (TPSA) | 64.60 Ų |
| XlogP | 6.90 |
| CHEMBL4166617 |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 96.68% | 99.17% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 96.14% | 97.29% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.95% | 98.95% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 94.84% | 89.63% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 94.01% | 96.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.33% | 96.09% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 93.28% | 97.21% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 92.87% | 91.11% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 91.61% | 94.45% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 91.14% | 92.86% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 89.86% | 89.34% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 88.71% | 94.33% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 88.40% | 90.17% |
| CHEMBL2885 | P07451 | Carbonic anhydrase III | 87.57% | 87.45% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 87.20% | 85.94% |
| CHEMBL2001 | Q9H244 | Purinergic receptor P2Y12 | 86.66% | 96.00% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 86.00% | 91.19% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.83% | 94.73% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 85.76% | 91.81% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 84.58% | 93.56% |
| CHEMBL2413 | P32246 | C-C chemokine receptor type 1 | 83.93% | 89.50% |
| CHEMBL4462 | Q8IXJ6 | NAD-dependent deacetylase sirtuin 2 | 82.47% | 90.24% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 81.60% | 92.29% |
| CHEMBL3267 | P48736 | PI3-kinase p110-gamma subunit | 81.59% | 95.71% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 81.48% | 100.00% |
| CHEMBL5163 | Q9NY46 | Sodium channel protein type III alpha subunit | 81.47% | 96.90% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 81.12% | 100.00% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 80.60% | 96.00% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 80.15% | 92.08% |
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compound!
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| PubChem | 139589823 |
| LOTUS | LTS0180875 |
| wikiData | Q104999078 |