Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 15/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17849249 | 0.85 | EGFR (0.40) | EGFRJAK2JAK1ALDH1A1 | |
| SCHEMBL17849188 | 0.85 | EGFR (0.40) | EGFRJAK2JAK1ALDH1A1 | |
| SCHEMBL16623568 | 0.83 | EGFR (0.38) | EGFRJAK2JAK1 | |
| SCHEMBL16623503 | 0.80 | EGFR (0.35) | EGFRJAK2JAK1 | |
| SCHEMBL17849221 | 0.79 | EIF2AK2 (0.34) | EGFRJAK2JAK1 | |
| SCHEMBL16623565 | 0.78 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL16623511 | 0.77 | TYK2 (0.38) | JAK2 | |
| SCHEMBL17849244 | 0.77 | TYK2 (0.40) | EGFRJAK2JAK1ALDH1A1 | |
| SCHEMBL18052623 | 0.77 | EGFR (0.36) | EGFRJAK2JAK1 | |
| SCHEMBL17849247 | 0.77 | MAPT (0.41) | EGFRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |