Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 12/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 13/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.37 |
| ▸ | FAP | Q12884 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6016558 | 0.92 | CYP3A4 (0.50) | CYP3A4CYP2D6HPRT1FAP | |
| SCHEMBL7148959 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP2D6HPRT1 | |
| SCHEMBL6901145 | 0.81 | CYP3A4 (0.62) | CYP3A4CYP2D6HPRT1FAP | |
| SCHEMBL6901159 | 0.81 | CYP3A4 (0.62) | CYP3A4CYP2D6HPRT1FAP | |
| SCHEMBL6016546 | 0.81 | CYP3A4 (0.51) | CYP3A4CYP2D6HPRT1 | |
| SCHEMBL6016555 | 0.81 | CYP3A4 (0.51) | CYP3A4CYP2D6HPRT1 | |
| SCHEMBL6016608 | 0.79 | CYP3A4 (0.57) | CYP3A4CYP2D6FAP | |
| SCHEMBL6897532 | 0.79 | CYP3A4 (0.61) | CYP3A4CYP2D6HPRT1FAP | |
| SCHEMBL6897542 | 0.79 | CYP3A4 (0.61) | CYP3A4CYP2D6HPRT1FAP | |
| SCHEMBL7148939 | 0.76 | CYP3A4 (0.51) | CYP3A4CYP2D6HPRT1FAP |
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-1244668-B1 | PURINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF | UNIVERSITAIRE INSTELLING ANTWE (BE) | 2006-04-05 | — | — | EP | claimed |