Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL11534457 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HPGDGSK3BMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11534554 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HPGDGSK3BMEN1KMT2A | |
| SCHEMBL5293402 | 0.83 | MAPT (0.43) | ALDH1A1HPGDMEN1KMT2ARAB9A | |
| SCHEMBL11540128 | 0.81 | HPGD (0.46) | ALDH1A1HPGDGSK3BMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11537284 | 0.80 | MEN1 (0.46) | ALDH1A1HPGDGSK3BMEN1KMT2A | |
| SCHEMBL546071 | 0.77 | SLC6A2 (0.42) | ALDH1A1HPGDMEN1KMT2ARAB9A | |
| SCHEMBL5147853 | 0.76 | CYP3A4 (0.46) | MEN1KMT2ARAB9AMAPTLMNA | |
| SCHEMBL647938 | 0.74 | ALDH1A1 (0.70) | ALDH1A1HPGDMEN1KMT2ARAB9A | |
| SCHEMBL5566562 | 0.74 | GAA (0.62) | ALDH1A1HPGDMEN1KMT2ARAB9A | |
| SCHEMBL13786376 | 0.74 | ATM (0.59) | ALDH1A1MEN1KMT2ARAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4048229-A | ANTAGONIST ACTIVITY | SMITHKLINE CORPORATION (US) | 1977-09-13 | — | — | US | disclosed |