Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GPX4 | P36969 | 1/20 | 0.41 |
| ▸ | STK17B | O94768 | 1/20 | 0.41 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 5/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13665283 | 0.80 | MAPK3 (0.39) | TDP1STK17BSTK17ADRD2LMNA | |
| SCHEMBL13664820 | 0.76 | RAB9A (0.47) | NPC1RAB9APAX8ALDH1A1TP53 | |
| SCHEMBL13664819 | 0.75 | STK17B (0.52) | TDP1STK17BSTK17ADRD2LMNA | |
| SCHEMBL15189256 | 0.75 | NPC1 (0.52) | NPC1RAB9APAX8ALDH1A1TP53 | |
| SCHEMBL17336558 | 0.74 | ALDH1A1 (0.41) | ALDH1A1STK17BSTK17ALMNASMN1; SMN2 | |
| SCHEMBL14830020 | 0.73 | PYGL (0.53) | TDP1STK17BSTK17ASMN1; SMN2CA1 | |
| SCHEMBL13664868 | 0.72 | STK17B (0.55) | TDP1STK17BSTK17ADRD2LMNA | |
| SCHEMBL14846343 | 0.72 | CA12 (0.60) | TDP1ALDH1A1STK17BSTK17ALMNA | |
| SCHEMBL30271526 | 0.71 | ALDH1A1 (0.53) | TDP1ALDH1A1STK17BSTK17ALMNA | |
| SCHEMBL7578637 | 0.71 | MTNR1A (0.46) | NPC1RAB9APAX8ALDH1A1TP53 |
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-2009119528-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |