Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL13664827 | 0.90 | SMN1; SMN2 (0.35) | ALDH1A1CXCR4SMN1; SMN2 | |
| SCHEMBL28329879 | 0.86 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL25040506 | 0.85 | — | — | |
| SCHEMBL25040502 | 0.85 | — | — | |
| SCHEMBL25040974 | 0.85 | — | — | |
| SCHEMBL30917712 | 0.85 | — | — | |
| SCHEMBL60021 | 0.84 | EPHX1 (0.32) | ALDH1A1EPHX1 | |
| SCHEMBL14027929 | 0.84 | EPHX1 (0.32) | ALDH1A1EPHX1 | |
| SCHEMBL12635200 | 0.84 | EPHX1 (0.32) | ALDH1A1EPHX1 | |
| SCHEMBL11920241 | 0.84 | EPHX1 (0.32) | ALDH1A1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104684548-A | Abuse deterrent pharmaceutical compositions for controlled release | EGALET LTD | 2015-06-03 | — | — | CN | disclosed |