Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | GHSR | Q92847 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | STAT1 | P42224 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL8968691 | 0.96 | EPHX1 (0.46) | EPHX1ALDH1A1HTTKCNH3MAPT | |
| SCHEMBL246721 | 0.85 | ALDH1A1 (0.59) | ALDH1A1KCNH3MAPTCA12CA9 | |
| SCHEMBL1333377 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KCNH3MAPTCA12CA9 | |
| Sulfuric Acid SCHEMBL22117415 | 0.82 | EPHX1 (0.57) | EPHX1ALDH1A1HTTKCNH3MAPT | |
| Water SCHEMBL20853620 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HTTKCNH3MAPTCA12 | |
| Sulfuric Acid SCHEMBL22117414 | 0.82 | EPHX1 (0.57) | EPHX1ALDH1A1HTTKCNH3MAPT | |
| SCHEMBL5524297 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HTTKCNH3MAPTCA12 | |
| SCHEMBL1607864 | 0.82 | ALDH1A1 (0.59) | ALDH1A1KCNH3MAPTCA12CA9 | |
| SCHEMBL8969772 | 0.80 | ALDH1A1 (0.57) | EPHX1ALDH1A1HTTKCNH3MAPT | |
| SCHEMBL8969604 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KCNH3MAPTCA12CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5510532-A | ANILINE DERIVATIVES CONTAINING ALKYLSULFONATE GROUP ON NITROGEN ATOM | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 1996-04-23 | — | — | US | disclosed |
| US-5500474-A | POLYANILINE SULFONATES | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 1996-03-19 | — | — | US | disclosed |