Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | SMO | Q99835 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3789950 | 0.89 | CA12 (0.48) | ALDH1A1KMT2AGAAMAPKAPK2CA12 | |
| SCHEMBL10083418 | 0.85 | CA12 (0.49) | ALDH1A1KMT2AGAAMAPKAPK2CA12 | |
| SCHEMBL4168732 | 0.82 | KMT2A (0.62) | ALDH1A1KMT2ACA12CA1CA9 | |
| SCHEMBL12071196 | 0.81 | CYP17A1 (0.51) | ALDH1A1KMT2AGAAMAPKAPK2CA12 | |
| SCHEMBL7130465 | 0.81 | MAPKAPK2 (0.41) | ALDH1A1KMT2AGAAIDO1MAPKAPK2 | |
| SCHEMBL7246123 | 0.80 | GAA (0.49) | ALDH1A1GAAMAPKAPK2CA1LMNA | |
| SCHEMBL4299949 | 0.80 | MEN1 (0.44) | ALDH1A1KMT2AGAACA12CA1 | |
| SCHEMBL16303890 | 0.80 | EPHX1 (0.58) | ALDH1A1KMT2AGAACA12CA1 | |
| SCHEMBL4299453 | 0.80 | MEN1 (0.54) | ALDH1A1KMT2AGAACA12CA1 | |
| SCHEMBL4013659 | 0.79 | NPC1 (0.59) | ALDH1A1GAAMAPKAPK2CA12CA1 |
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-0798292-B1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) | 2004-11-03 | — | — | EP | disclosed |