Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.39 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.37 |
| ▸ | BCHE | P06276 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9269176 | 0.83 | MAPT (0.39) | ALDH1A1GAAMAPTHTTKDM4E | |
| SCHEMBL9265990 | 0.83 | LMNA (0.41) | ALDH1A1MAPTHTTKDM4ENPC1 | |
| SCHEMBL404108 | 0.80 | ALDH1A1 (0.53) | ALDH1A1GAAMAPTCYP1A2CYP2D6 | |
| SCHEMBL9260020 | 0.79 | MAPT (0.53) | ALDH1A1GAAMAPTHTTMEN1 | |
| SCHEMBL9266044 | 0.78 | KDM4E (0.44) | ALDH1A1MAPTHTTKDM4ENPC1 | |
| SCHEMBL31663132 | 0.76 | MPO (0.51) | ALDH1A1MAPTKDM4EMEN1NPC1 | |
| SCHEMBL11807689 | 0.72 | KDM4E (0.59) | ALDH1A1GAAMAPTKDM4EMEN1 | |
| SCHEMBL11685844 | 0.70 | CYP1A2 (0.65) | ALDH1A1MAPTCYP1A2CYP2D6HTT | |
| SCHEMBL9258621 | 0.69 | GRIN1 (0.36) | ALDH1A1GAAMAPTMEN1LMNA | |
| SCHEMBL11634646 | 0.69 | HSP90AB1 (0.48) | ALDH1A1GAAMAPTKDM4EMEN1 |
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-5387585-A | Treating epilepsy, anxiety, sleep disorders, schizophrnia, senile dementia | HOFFMANN-LA ROCHE INC. (US) | 1995-02-07 | — | — | US | disclosed |
| EP-0519307-A2 | Tetracyclic Imidazodiazepines | F. HOFFMANN-LA ROCHE AG (CH) | 1992-12-23 | — | — | EP | disclosed |