Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | RAF1 | P04049 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18308342 | 0.90 | PDE2A (0.36) | PLK1ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL18308505 | 0.88 | MAPT (0.34) | MAPT | |
| SCHEMBL18308325 | 0.87 | KDM4E (0.35) | ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL18308537 | 0.86 | MAPT (0.36) | PLK1ALDH1A1TSHRMAPT | |
| SCHEMBL18308508 | 0.85 | KIT (0.38) | PLK1PRKDCGRIN1GRIN2BEGFR | |
| SCHEMBL18308332 | 0.85 | KIT (0.35) | PLK1PRKDCALDH1A1TSHRMAP2K1 | |
| SCHEMBL18308334 | 0.83 | MAPT (0.33) | MAPT | |
| SCHEMBL18308539 | 0.83 | MET (0.37) | PRKDCALDH1A1TSHRMAPT | |
| SCHEMBL18308506 | 0.81 | ALDH1A1 (0.37) | PLK1ALDH1A1MEN1RAB9AKMT2A | |
| SCHEMBL18308331 | 0.81 | RECQL (0.35) | ALDH1A1TSHRMEN1KMT2AMAPT |
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-2016199943-A1 | HETEROCYCLIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-12-15 | — | — | WO | disclosed |