Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6676279 | 0.85 | AOC1 (0.36) | ALDH1A1HTT | |
| SCHEMBL6680152 | 0.85 | AOC1 (0.40) | MAPTALDH1A1TSHRHTT | |
| SCHEMBL6676116 | 0.84 | KCNK3 (0.50) | POLBRAB9AMAPTNPC1CYP1A2 | |
| Hydrochloric Acid SCHEMBL6677482 | 0.84 | AOC1 (0.42) | MAPTALDH1A1TSHRHTT | |
| Hydrochloric Acid SCHEMBL6678103 | 0.84 | AOC1 (0.38) | HTT | |
| SCHEMBL6678172 | 0.82 | ALDH1A1 (0.34) | MAPTALDH1A1CYP1A2HTT | |
| Hydrochloric Acid SCHEMBL6675078 | 0.81 | HTT (0.33) | MAPTALDH1A1HTT | |
| SCHEMBL6681980 | 0.80 | ALDH1A1 (0.35) | TDP1RAB9AMAPTALDH1A1NPC1 | |
| SCHEMBL6676315 | 0.79 | CYP1A2 (0.36) | POLBRAB9AMAPTALDH1A1NPC1 | |
| SCHEMBL6676056 | 0.79 | KDM4C (0.40) | POLBALDH1A1CYP1A2HTT |
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 | claimed |