Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 6/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.36 |
| ▸ | GAPDH | P04406 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28202884 | 0.79 | TSHR (0.40) | TSHRSMN1; SMN2CTSKMAPTTRPA1 | |
| SCHEMBL26558294 | 0.79 | CTSK (0.41) | TSHRSMN1; SMN2CTSKCYP3A4CTSL | |
| SCHEMBL3034932 | 0.76 | TSHR (0.42) | TSHRSMN1; SMN2CTSKCYP3A4CTSL | |
| SCHEMBL3024808 | 0.73 | ADH1B (0.42) | PTPN1TSHRSMN1; SMN2CTSKMAPT | |
| SCHEMBL3038658 | 0.72 | TSHR (0.42) | TSHRSMN1; SMN2CTSKCYP3A4CTSL | |
| SCHEMBL3034857 | 0.72 | TSHR (0.44) | TSHRSMN1; SMN2CTSKCYP3A4CA1 | |
| SCHEMBL30580550 | 0.71 | TRPA1 (0.47) | MAPTTRPA1DDAH1GAPDHFDPS | |
| SCHEMBL8449830 | 0.70 | — | — | |
| SCHEMBL93127 | 0.70 | — | — | |
| SCHEMBL11686269 | 0.70 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8410033-B2 | Preparation of diester-based biolubricants from monoesters of fatty acids and olefin-derived vicinal diols | CHEVRON U.S.A. INC. (US) | 2013-04-02 | — | — | US | disclosed |
| US-20120053099-A1 | PREPARATION OF DIESTER-BASED BIOLUBRICANTS FROM MONOESTERS OF FATTY ACIDS AND OLEFIN-DERIVED VICINAL DIOLS | CHEVRON U.S.A. INC. (US) | 2012-03-01 | — | — | US | disclosed |