Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 3/20 | 0.33 |
| ▸ | PRKDC | P78527 | 5/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 3/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.31 |
| ▸ | ZAP70 | P43403 | 2/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 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 | |
|---|---|---|---|---|
| SCHEMBL17849188 | 0.85 | EGFR (0.40) | EGFRNPC1RAB9ACCNT1CCNE1 | |
| SCHEMBL16623509 | 0.82 | NPC1 (0.46) | EGFRNPC1RAB9ACCNT1CCNE1 | |
| SCHEMBL17849247 | 0.79 | MAPT (0.41) | EGFRNPC1RAB9AZAP70 | |
| SCHEMBL16623453 | 0.78 | EGFR (0.31) | EGFR | |
| SCHEMBL16726647 | 0.78 | — | — | |
| SCHEMBL17849244 | 0.77 | TYK2 (0.40) | EGFRMAPK14ZAP70 | |
| SCHEMBL17849227 | 0.76 | TYK2 (0.42) | EGFRMAPK14ZAP70 | |
| SCHEMBL16623493 | 0.76 | TYK2 (0.39) | — | |
| SCHEMBL17849249 | 0.76 | EGFR (0.40) | EGFR | |
| SCHEMBL17849245 | 0.75 | NPC1 (0.41) | EGFRNPC1RAB9AAKT1 |
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 |