Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 2/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.32 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.32 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.32 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.32 |
| ▸ | MTOR | P42345 | 2/20 | 0.32 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL22200324 | 0.86 | ERN1 (0.40) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL25035424 | 0.85 | ERN1 (0.45) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL22200701 | 0.83 | ERN1 (0.42) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL22200561 | 0.82 | ERN1 (0.39) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL22200368 | 0.81 | ERN1 (0.35) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL22200534 | 0.80 | ERN1 (0.39) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL25035286 | 0.80 | ERN1 (0.47) | BRAFERN1PIK3CAMTOR | |
| SCHEMBL25035658 | 0.79 | ERN1 (0.38) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL22200580 | 0.79 | ERN1 (0.37) | BRAFERN1FGFR1FGFR2FGFR4 | |
| SCHEMBL25035331 | 0.78 | BRAF (0.54) | BRAFERN1 |
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-2020142612-A1 | PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AS INHIBITORS OF ENDORIBONUCLEASE INOSITOL REQUIRING ENZYME I (IRE I ALPHA) FOR THE TREATMENT OF CANCER DISEASES. | GENENTECH, INC. (US) | 2020-07-09 | — | — | WO | disclosed |