Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ADCY5 | O95622 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8464539 | 0.84 | CYP1A2 (0.46) | CYP1A2CYP2D6MAPK1ADCY5 | |
| SCHEMBL8464552 | 0.84 | CYP1A2 (0.46) | CYP1A2CYP2D6MAPK1ADCY5 | |
| Bch-1393 SCHEMBL4983771 | 0.80 | CYP1A2 (0.41) | CYP1A2CYP2D6MAPK1ADCY5 | |
| Bch-1393 SCHEMBL8466563 | 0.80 | CYP1A2 (0.41) | CYP1A2CYP2D6MAPK1ADCY5 | |
| Bch-1393 SCHEMBL14203135 | 0.80 | CYP1A2 (0.41) | CYP1A2CYP2D6MAPK1ADCY5 | |
| SCHEMBL8467088 | 0.79 | CYP1A2 (0.42) | CYP1A2CYP2D6MAPK1ADCY5 | |
| SCHEMBL8464129 | 0.79 | CYP1A2 (0.42) | CYP1A2CYP2D6MAPK1ADCY5 | |
| SCHEMBL8464512 | 0.73 | CYP1A2 (0.73) | CYP1A2CYP2D6MAPK1ADCY5 | |
| SCHEMBL8464772 | 0.73 | CYP1A2 (0.73) | CYP1A2CYP2D6MAPK1ADCY5 | |
| SCHEMBL10896726 | 0.72 | ADCY5 (0.40) | CYP1A2CYP2D6ADCY5 |
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-5994361-A | ANTITUMOR, ANTICANCER AGENT | BIOCHEM PHARMA (CA) | 1999-11-30 | — | — | US | claimed |