Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KCNB1 | Q14721 | 3/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 SCHEMBL7241201 | 0.99 | ALDH1A1 (0.34) | ALDH1A1FSCN1MAPTLMNAMAPK1 | |
| SCHEMBL6674705 | 0.86 | HTT (0.37) | ALDH1A1LMNASMN1; SMN2HTTKCNB1 | |
| SCHEMBL6676319 | 0.85 | NR1H4 (0.35) | ALDH1A1LMNAKDM4CHTTKCNB1 | |
| Hydrochloric Acid SCHEMBL7236369 | 0.84 | NR1H4 (0.34) | LMNAKCNB1KCNH2KCNB2NR1H4 | |
| SCHEMBL6674904 | 0.83 | AOC1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL6680940 | 0.82 | AOC1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL27564544 | 0.82 | FSCN1 (0.35) | ALDH1A1FSCN1MAPTLMNAMAPK1 | |
| SCHEMBL6678172 | 0.80 | ALDH1A1 (0.34) | ALDH1A1MAPTLMNAKDM4CKMT2A | |
| SCHEMBL6677574 | 0.80 | TNIK (0.38) | ALDH1A1MAPTRAB9ANPC1HTT | |
| SCHEMBL6681985 | 0.79 | PTGIR (0.40) | ALDH1A1FSCN1MAPTLMNAMAPK1 |
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 |