Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA6 | P23280 | 4/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CA3 | P07451 | 3/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.48 |
| ▸ | CA7 | P43166 | 3/20 | 0.48 |
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Trientine SCHEMBL29145946 | 0.91 | CA12 (0.58) | CA6CA14ALDH1A1CA3ALOX15 | |
| SCHEMBL11120368 | 0.89 | CA12 (0.61) | CA6CA14ALDH1A1CA3ALOX15 | |
| 4-Aminophenol SCHEMBL28330028 | 0.81 | ALDH1A1 (0.77) | CA6CA14ALDH1A1CA3ALOX15 | |
| Trientine SCHEMBL29145959 | 0.81 | CYP1A2 (0.47) | CA6CA14ALDH1A1CA3ALOX15 | |
| Trientine SCHEMBL29145924 | 0.81 | ALOX15 (0.54) | CA6CA14ALDH1A1CA3ALOX15 | |
| Trientine SCHEMBL29145939 | 0.80 | CA12 (0.50) | CA6CA14ALDH1A1CA3ALOX15 | |
| Phenol SCHEMBL27906283 | 0.80 | CA12 (0.50) | CA6CA14ALDH1A1CA3ALOX15 | |
| Phenol SCHEMBL29145941 | 0.80 | CA12 (0.50) | CA6CA14ALDH1A1CA3ALOX15 | |
| SCHEMBL28989551 | 0.79 | APP (0.47) | CA6CA14ALDH1A1CA3ALOX15 | |
| SCHEMBL29145936 | 0.79 | APP (0.47) | CA6CA14ALDH1A1CA3ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-4000201-A | ALKYL ETHER, CROSSLINKED SULFIDE POLYMER | DYNAPOL CORPORATION (US) | 1976-12-28 | — | — | US | disclosed |