Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL20257873 | 0.77 | — | — | |
| SCHEMBL20457715 | 0.73 | — | — | |
| SCHEMBL5889479 | 0.70 | NOS1 (0.34) | NOS1 | |
| SCHEMBL13078397 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL11623790 | 0.68 | LDHA (0.33) | — | |
| Hydrochloric Acid SCHEMBL11623786 | 0.68 | LDHA (0.33) | — | |
| SCHEMBL5889478 | 0.68 | NOS1 (0.38) | NOS1 | |
| SCHEMBL11159471 | 0.66 | ALDH1A1 (0.38) | NOS1ALDH1A1CYP3A4 | |
| SCHEMBL360164 | 0.64 | — | — | |
| SCHEMBL3072196 | 0.64 | — | — |
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-2020206000-A1 | BIVALENT ANTAGONISTS OF INHIBITORS OF APOPTOSIS PROTEINS | Hepagene Therapeutics (HK) Limited (CN) | 2020-10-08 | — | — | WO | disclosed |