Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | TYMS | P04818 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19488261 | 1.00 | ALDH1A1 (0.33) | ALDH1A1SMN1; SMN2BACE1TYMS | |
| SCHEMBL19488788 | 0.84 | TYMS (0.32) | TYMS | |
| SCHEMBL12403381 | 0.83 | AAK1 (0.31) | — | |
| SCHEMBL19488494 | 0.80 | — | — | |
| SCHEMBL10202476 | 0.80 | — | — | |
| SCHEMBL19488530 | 0.78 | BACE1 (0.33) | ALDH1A1BACE1TYMS | |
| SCHEMBL19488529 | 0.77 | CDC7 (0.40) | BACE1TYMS | |
| SCHEMBL19488597 | 0.77 | — | — | |
| SCHEMBL19488785 | 0.75 | TYMS (0.31) | TYMS | |
| SCHEMBL14758479 | 0.74 | CDC7 (0.48) | BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2601188-B1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-10-18 | — | — | EP | disclosed |