Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10614219 | 0.83 | ADORA2B (0.52) | ADORA2AADORA2BADORA3 | |
| SCHEMBL10626163 | 0.69 | CYP3A4 (0.44) | ADORA2AADORA2BSMN1; SMN2CYP3A4ADORA3 | |
| SCHEMBL10614388 | 0.68 | ADORA2B (0.60) | ADORA2AADORA2BCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL4650748 | 0.67 | ADORA2B (0.74) | ADORA2AADORA2BCYP1A2CYP3A4MEN1 | |
| SCHEMBL9158476 | 0.67 | ADORA2B (0.53) | ADORA2AADORA2BADORA3 | |
| SCHEMBL9158460 | 0.67 | ADORA2B (0.53) | ADORA2AADORA2BADORA3 | |
| SCHEMBL9453179 | 0.67 | CYP3A4 (0.42) | ADORA2AADORA2BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10627290 | 0.65 | ADORA2B (0.33) | ADORA2AADORA2BCYP3A4ADORA3 | |
| SCHEMBL10614242 | 0.65 | ADORA2B (0.53) | ADORA2AADORA2B | |
| SCHEMBL10614807 | 0.64 | ADORA2B (0.57) | ADORA2BCYP1A2CYP3A4ALDH1A1HPGD |
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-4772607-A | ALZHEIMER*S DISEASE, CNS STIMULANT, ANTIFIBRILLATORY, BRONCHODILATOR | WARNER-LAMBERT COMPANY (US) | 1988-09-20 | — | — | US | disclosed |