Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.46 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12868275 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL10128070 | 0.88 | ALDH1A1 (0.60) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL10127902 | 0.88 | ALDH1A1 (0.60) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL12868289 | 0.84 | ALDH1A1 (0.56) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL11089644 | 0.84 | ALDH1A1 (0.45) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL12868238 | 0.83 | HTR6 (0.51) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL12868271 | 0.82 | LMNA (0.59) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL12882701 | 0.81 | MAPT (0.66) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL29223991 | 0.79 | ALDH1A1 (0.67) | ALDH1A1MAPK1MAPTLMNATSHR | |
| SCHEMBL12868618 | 0.77 | ALDH1A1 (0.65) | ALDH1A1MAPK1MAPTLMNATSHR |
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-2184064-A2 | LIGANDS OF 5-HT6 RECEPTORS, A PHARMACEUTICAL COMPOSITION, METHOD FOR THE PRODUCTION AND USE THEREOF | Alla Chem, LLC. (US) | 2010-05-12 | — | — | EP | disclosed |