Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LAP3 | P28838 | 2/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29328248 | 0.83 | OPRM1 (0.39) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL26025316 | 0.77 | OPRM1 (0.48) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL14605594 | 0.77 | OPRM1 (0.48) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL19596576 | 0.77 | OPRM1 (0.48) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL25667496 | 0.77 | — | — | |
| SCHEMBL11206177 | 0.77 | — | — | |
| SCHEMBL20734476 | 0.76 | SPHK1 (0.48) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL19650484 | 0.76 | SPHK1 (0.48) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL12128370 | 0.75 | ANPEP (0.34) | OPRM1SPHK1TP53LAP3GRIK1 | |
| SCHEMBL22783114 | 0.75 | — | — |
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-2020254547-A1 | NEW EGFR INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2020-12-24 | — | — | WO | disclosed |