Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.34 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | MAPKAPK2 | P49137 | 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 | |
|---|---|---|---|---|
| SCHEMBL14398302 | 0.78 | RAB9A (0.46) | PTGS1PTGS2NPC1RAB9AMAPT | |
| SCHEMBL10387054 | 0.71 | PTGS1 (0.65) | PTGS1PTGS2NPC1RAB9AMAPT | |
| SCHEMBL19603145 | 0.68 | HRH3 (0.51) | ALDH1A1MEN1KMT2AHRH3HTR1A | |
| SCHEMBL11452892 | 0.64 | HRH3 (0.50) | MAPTALDH1A1MEN1KMT2AHRH3 | |
| SCHEMBL11452893 | 0.64 | HRH3 (0.50) | MAPTALDH1A1MEN1KMT2AHRH3 | |
| SCHEMBL20314430 | 0.64 | NPC1 (0.52) | PTGS1PTGS2NPC1RAB9AMAPT | |
| SCHEMBL13180253 | 0.63 | HDAC6 (0.52) | MAPTALDH1A1MEN1KMT2AHRH3 | |
| SCHEMBL19368860 | 0.62 | HRH3 (0.46) | MAPTALDH1A1MEN1KMT2AHRH3 | |
| SCHEMBL28389066 | 0.62 | PTGS1 (0.54) | PTGS1PTGS2NPC1RAB9AMAPT | |
| SCHEMBL11576297 | 0.61 | HRH3 (0.50) | MAPTALDH1A1MEN1KMT2AHRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2018847-B1 | Hair composition comprising at least one direct disulfide dye and at least one alkali hydroxide agent and method of simultaneous styling and dyeing. | ORÉAL L (FR) | 2014-09-17 | — | — | EP | disclosed |