Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 8/20 | 0.64 |
| ▸ | NPC1 | O15118 | 4/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.64 |
| ▸ | RAB9A | P51151 | 3/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.64 |
| ▸ | MMP2 | P08253 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
| ▸ | MMP1 | P03956 | 1/20 | 0.52 |
| ▸ | MMP3 | P08254 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.52 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1757034 | 1.00 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL1756853 | 1.00 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL78650 | 1.00 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL28098897 | 0.97 | EPHX1 (0.61) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL966688 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL27740151 | 0.95 | EPHX1 (0.56) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| Urea SCHEMBL28834423 | 0.95 | EPHX1 (0.56) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL688635 | 0.92 | — | — | |
| SCHEMBL15277766 | 0.91 | EPHX1 (0.74) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL27565992 | 0.90 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016188988-A1 | COSMETIC COMPOSITIONS COMPRISING E/Z-2-BENZYLINDENE-5,6-DIMETHOXY-3,3-DIMETHYLINDAN-1-ONE | SYMRISE AG (DE) | 2016-12-01 | — | — | WO | disclosed |
| WO-2016189024-A1 | COSMETIC COMPOSITIONS COMPRISING SCLAREOLIDE | SYMRISE AG (DE) | 2016-12-01 | — | — | WO | disclosed |
| WO-2016189046-A1 | COSMETIC COMPOSITIONS COMPRISING PURPLE CONEFLOWER PRESSED JUICE | SYMRISE AG (DE) | 2016-12-01 | — | — | WO | disclosed |
| WO-2016189038-A1 | COSMETIC COMPOSITIONS COMPRISING GINGER ROOT EXTRACTS | SYMRISE AG (DE) | 2016-12-01 | — | — | WO | disclosed |