Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3506547 | 0.82 | ADORA2A (0.46) | — | |
| SCHEMBL27035498 | 0.80 | HDAC6 (0.35) | — | |
| SCHEMBL9014630 | 0.74 | FDPS (0.36) | CYP1A2MAPK1 | |
| SCHEMBL28480707 | 0.73 | CDK1 (0.47) | — | |
| SCHEMBL2983374 | 0.68 | DYRK1A (0.46) | — | |
| SCHEMBL9604572 | 0.67 | CYP1A2 (0.69) | CYP1A2CYP2D6MAPK1 | |
| SCHEMBL9705702 | 0.66 | CYP1A2 (0.62) | CYP1A2CYP2D6MAPK1 | |
| SCHEMBL22399280 | 0.65 | CYP1A2 (0.76) | CYP1A2CYP2D6MAPK1 | |
| SCHEMBL22399527 | 0.65 | CYP1A2 (0.57) | CYP1A2CYP2D6MAPK1 | |
| SCHEMBL120720 | 0.64 | ADORA2A (0.49) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0708653-B1 | ASSAY AND REAGENTS FOR IDENTIFYING ANTI-PROLIFERATIVE AGENTS | MITOTIX INC (US) | 2002-05-08 | — | — | EP | claimed |