Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | MME | P08473 | 2/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13054596 | 0.77 | SMN1; SMN2 (0.50) | CYP3A4RAB9A | |
| SCHEMBL13054604 | 0.77 | SMN1; SMN2 (0.50) | CYP3A4RAB9A | |
| SCHEMBL4302711 | 0.74 | CPA1 (0.55) | CYP3A4MAPK1NPC1RAB9AMME | |
| SCHEMBL20272616 | 0.74 | CPA1 (0.55) | CYP3A4MAPK1NPC1RAB9AMME | |
| SCHEMBL7506620 | 0.74 | CPA1 (0.55) | CYP3A4MAPK1NPC1RAB9AMME | |
| SCHEMBL24712875 | 0.73 | TAAR1 (0.48) | CYP3A4MAPK1NPC1RAB9AEPHX1 | |
| SCHEMBL3791285 | 0.71 | TAAR1 (0.47) | CYP3A4MAPK1NPC1RAB9AEPHX1 | |
| SCHEMBL16509234 | 0.70 | OPRM1 (0.46) | CYP3A4MAPK1NPC1RAB9AEPHX1 | |
| Hydrochloric Acid SCHEMBL2035354 | 0.70 | OPRM1 (0.46) | CYP3A4MAPK1NPC1RAB9AEPHX1 | |
| SCHEMBL7506611 | 0.70 | ABCB1 (0.48) | CYP3A4MAPK1NPC1RAB9AEPHX1 |
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-9409952-B2 | Peptide-compound cyclization method | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2016-08-09 | — | — | US | disclosed |