Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.48 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 9/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 9/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3037638 | 0.99 | HDAC1 (0.48) | HDAC1CHRM4DUSP3MAPTALDH1A1 | |
| SCHEMBL6482561 | 0.98 | DUSP3 (0.48) | HDAC1CHRM4DUSP3MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL3047354 | 0.97 | DUSP3 (0.47) | HDAC1CHRM4DUSP3MAPTALDH1A1 | |
| SCHEMBL6476610 | 0.87 | DUSP3 (0.48) | HDAC1CHRM4DUSP3MAPTALDH1A1 | |
| SCHEMBL6476277 | 0.86 | DUSP3 (0.53) | CHRM4DUSP3ADORA2AADORA2BADORA1 | |
| Hydrochloric Acid SCHEMBL3057668 | 0.86 | DUSP3 (0.48) | HDAC1CHRM4DUSP3MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL3045899 | 0.86 | DUSP3 (0.53) | CHRM4DUSP3ADORA2AADORA2BADORA1 | |
| SCHEMBL3046423 | 0.85 | DUSP3 (0.56) | CHRM4DUSP3ADORA2AADORA2BADORA1 | |
| SCHEMBL6477408 | 0.85 | DUSP3 (0.52) | CHRM4DUSP3ALDH1A1ADORA2AADORA2B | |
| SCHEMBL6476606 | 0.84 | ADORA2B (0.50) | CHRM4DUSP3MAPTALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6963000-B2 | Benzothiazole derivatives with activity as adenosine receptor ligands | HOFFMAN-LA ROCHE INC. (US) | 2005-11-08 | — | — | US | claimed |