Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 7/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 3/20 | 0.33 |
| ▸ | GAK | O14976 | 2/20 | 0.33 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.33 |
| ▸ | COQ8A | Q8NI60 | 2/20 | 0.33 |
| ▸ | NLK | Q9UBE8 | 2/20 | 0.33 |
| ▸ | IDH1 | O75874 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.32 |
| ▸ | PRKDC | P78527 | 2/20 | 0.32 |
| ▸ | STK4 | Q13043 | 1/20 | 0.32 |
| ▸ | ACP1 | P24666 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18308352 | 0.92 | EGFR (0.42) | MAP2K1KITRAF1GAKEGFR | |
| SCHEMBL18308508 | 0.78 | KIT (0.38) | KITEGFRERBB2PRKDC | |
| SCHEMBL18308509 | 0.75 | PLK1 (0.38) | MAP2K1RAF1EGFRERBB2PRKDC | |
| SCHEMBL18308389 | 0.73 | MET (0.34) | — | |
| SCHEMBL18308334 | 0.72 | MAPT (0.33) | — | |
| SCHEMBL18308342 | 0.72 | PDE2A (0.36) | KDM4E | |
| SCHEMBL18308505 | 0.71 | MAPT (0.34) | KDM4EKIT | |
| SCHEMBL18308384 | 0.71 | APLNR (0.35) | — | |
| SCHEMBL18308538 | 0.70 | VCP (0.32) | — | |
| SCHEMBL18308554 | 0.70 | BRD4 (0.32) | — |
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 |