Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11261196 | 1.00 | ALDH1A1 (0.44) | ALDH1A1PLCG1CYP2C9CYP2C19ADAMTS5 | |
| SCHEMBL11267598 | 0.91 | ALDH1A1 (0.43) | ALDH1A1PLCG1CYP2C9CYP2C19ADAMTS5 | |
| SCHEMBL11267596 | 0.91 | ALDH1A1 (0.43) | ALDH1A1PLCG1CYP2C9CYP2C19ADAMTS5 | |
| SCHEMBL11264996 | 0.88 | PTPN1 (0.42) | ALDH1A1 | |
| SCHEMBL11265005 | 0.88 | PTPN1 (0.42) | ALDH1A1 | |
| SCHEMBL11270375 | 0.86 | PLCG1 (0.44) | ALDH1A1PLCG1CYP2C9CYP2C19ADAMTS5 | |
| SCHEMBL11270374 | 0.86 | PLCG1 (0.44) | ALDH1A1PLCG1CYP2C9CYP2C19ADAMTS5 | |
| SCHEMBL10402788 | 0.85 | ELANE (0.45) | ALDH1A1 | |
| SCHEMBL10402700 | 0.85 | ELANE (0.45) | ALDH1A1 | |
| SCHEMBL11255951 | 0.83 | ALDH1A1 (0.41) | ALDH1A1CYP2C19 |
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-4364865-A | ANTIBIOTICS | CIBA-GEIGY CORPORATION (US) | 1982-12-21 | — | — | US | disclosed |
| US-4070477-A | PENICILLINS | CIBA-GEIGY CORPORATION (US) | 1978-01-24 | — | — | US | disclosed |