Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11236145 | 0.85 | ALDH1A1 (0.36) | ADORA2BALDH1A1TDP1HTT | |
| SCHEMBL15413590 | 0.77 | TP53 (0.33) | — | |
| SCHEMBL11233995 | 0.76 | LMNA (0.35) | ALDH1A1TDP1 | |
| SCHEMBL11230853 | 0.72 | ADORA2B (0.37) | ADORA2BALDH1A1TDP1HTT | |
| SCHEMBL11245890 | 0.71 | MEN1 (0.39) | ADORA2BALDH1A1 | |
| SCHEMBL11240899 | 0.67 | ALDH1A1 (0.38) | ALDH1A1TDP1HTT | |
| SCHEMBL11243690 | 0.67 | ALDH1A1 (0.38) | ALDH1A1TDP1HTT | |
| SCHEMBL11235283 | 0.67 | ALDH1A1 (0.39) | ADORA2BALDH1A1TDP1HTT | |
| SCHEMBL11250408 | 0.66 | ALDH1A1 (0.40) | ADORA2BALDH1A1TDP1HTT | |
| SCHEMBL11233534 | 0.65 | TP53 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4329460-A | ANTICANCER AGENTS, ANTIVIRAL AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-05-11 | — | — | US | claimed |
| US-4329460-A | ANTICANCER AGENTS, ANTIVIRAL AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-05-11 | — | — | US | disclosed |