Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 9/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18262000 | 0.87 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL1757034 | 0.87 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL78650 | 0.87 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL1756853 | 0.87 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| Urea SCHEMBL28834423 | 0.87 | EPHX1 (0.56) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| Hydrochloric Acid SCHEMBL28098897 | 0.85 | EPHX1 (0.61) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL966688 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL27740151 | 0.83 | EPHX1 (0.56) | EPHX1NPC1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL22686540 | 0.81 | SMYD3 (0.46) | EPHX2MMP2MMP8 | |
| SCHEMBL688635 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102952042-A | Synthesis process of novel synthetic rubber accelerator N-cyclohexylurea | JIANGSU TAICANG AGRICULTURAL CHEMICALS CO LTD | 2013-03-06 | — | — | CN | claimed |