Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 14/20 | 0.65 |
| ▸ | FAP | Q12884 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 14/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7268779 | 0.92 | CYP3A4 (0.76) | CYP3A4FAPCYP2D6 | |
| SCHEMBL13983477 | 0.92 | CYP3A4 (0.76) | CYP3A4FAPCYP2D6 | |
| SCHEMBL7267656 | 0.92 | CYP3A4 (0.76) | CYP3A4FAPCYP2D6 | |
| SCHEMBL13360604 | 0.86 | CYP3A4 (0.58) | CYP3A4FAPCYP2D6ADORA2AADORA1 | |
| SCHEMBL13360612 | 0.82 | CYP3A4 (0.56) | CYP3A4FAPCYP2D6ADORA2AADORA1 | |
| SCHEMBL15070860 | 0.82 | CYP3A4 (0.77) | CYP3A4FAPCYP2D6ADORA2AADORA1 | |
| SCHEMBL16638756 | 0.81 | CYP3A4 (0.76) | CYP3A4FAPCYP2D6 | |
| SCHEMBL24809663 | 0.81 | CYP3A4 (0.74) | CYP3A4FAPCYP2D6 | |
| SCHEMBL1393451 | 0.81 | CYP3A4 (0.74) | CYP3A4FAPCYP2D6 | |
| SCHEMBL1393452 | 0.81 | CYP3A4 (0.74) | CYP3A4FAPCYP2D6 |
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-7157448-B2 | Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same | LG LIFE SCIENCES LTD. (KR) | 2007-01-02 | — | — | US | disclosed |