Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7245278 | 0.99 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AHTTACHE | |
| SCHEMBL6680855 | 0.85 | HTT (0.45) | ALDH1A1MEN1KMT2AHTTLMNA | |
| SCHEMBL6678294 | 0.84 | HTT (0.44) | ALDH1A1MEN1KMT2AHTTLMNA | |
| Hydrochloric Acid SCHEMBL6676152 | 0.84 | HTT (0.44) | ALDH1A1MEN1KMT2AHTTLMNA | |
| SCHEMBL6682225 | 0.83 | TAAR1 (0.49) | HTT | |
| Hydrochloric Acid SCHEMBL6684020 | 0.83 | HTT (0.43) | ALDH1A1MEN1KMT2AHTTLMNA | |
| SCHEMBL6679031 | 0.76 | ALDH1A1 (0.51) | ALDH1A1MEN1KMT2AACHELMNA | |
| SCHEMBL6678263 | 0.75 | PTGIR (0.49) | ALDH1A1MEN1KMT2AACHELMNA | |
| SCHEMBL6677060 | 0.75 | HTT (0.38) | ALDH1A1HTTACHELMNA | |
| SCHEMBL6675650 | 0.75 | TAAR1 (0.44) | HTT |
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 |