Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCA | P17252 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16652785 | 1.00 | PRKCA (0.35) | PRKCAHTTMEN1THRBKMT2A | |
| SCHEMBL16652691 | 1.00 | PRKCA (0.35) | PRKCAHTTMEN1THRBKMT2A | |
| SCHEMBL9938127 | 0.95 | CYP3A4 (0.33) | PRKCAMEN1KMT2AMAPK1EPHX2 | |
| SCHEMBL9937377 | 0.87 | CYP3A4 (0.35) | MEN1KMT2AMAPTMAPK1ABCB11 | |
| SCHEMBL27626101 | 0.80 | TSHR (0.40) | PRKCAHTTGAAMAPK1SMN1; SMN2 | |
| SCHEMBL27626110 | 0.80 | TSHR (0.40) | PRKCAHTTGAAMAPK1SMN1; SMN2 | |
| SCHEMBL27646369 | 0.80 | TSHR (0.40) | PRKCAHTTGAAMAPK1SMN1; SMN2 | |
| SCHEMBL27626055 | 0.80 | TSHR (0.40) | PRKCAHTTGAAMAPK1SMN1; SMN2 | |
| SCHEMBL27646508 | 0.80 | TSHR (0.40) | PRKCAHTTGAAMAPK1SMN1; SMN2 | |
| SCHEMBL27646458 | 0.80 | TSHR (0.40) | PRKCAHTTGAAMAPK1SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012082826-A1 | GLYCOL ETHER-BASED CYCLOHEXANOATE ESTERS, THEIR SYNTHESIS AND METHODS OF USE | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2012-06-21 | — | — | WO | disclosed |