Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8711943 | 0.94 | CYP1A2 (0.55) | ALDH1A1GRM5CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8709573 | 0.90 | SLC6A7 (0.50) | ALDH1A1MAPK1L3MBTL1HSD11B1KMT2A | |
| SCHEMBL7861475 | 0.83 | ALDH1A1 (0.50) | ALDH1A1GRM5CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8442349 | 0.81 | SMN1; SMN2 (0.59) | ALDH1A1GRM5CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7866478 | 0.79 | MAPK1 (0.47) | ALDH1A1RAB9AMAPK1L3MBTL1SMN1; SMN2 | |
| SCHEMBL8441843 | 0.76 | ALDH1A1 (0.49) | ALDH1A1CYP2C9CYP2C19LMNAL3MBTL1 | |
| SCHEMBL9688666 | 0.75 | GRM5 (0.54) | ALDH1A1GRM5CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7868152 | 0.74 | CYP1A2 (0.51) | ALDH1A1GRM5CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13149365 | 0.74 | SLC6A7 (0.70) | ALDH1A1L3MBTL1KMT2A | |
| SCHEMBL4563772 | 0.74 | CYP1A2 (0.69) | ALDH1A1GRM5CYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998054140-A1 | NOVEL TEREPHTHALAMIDE DERIVATIVES | DONGWHA PHARMACEUTICAL IND. CO., LTD. (KR) | 1998-12-03 | — | — | WO | disclosed |