Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9745860 | 1.00 | ATM (0.47) | ATMNPC1RAB9AMEN1KMT2A | |
| SCHEMBL7287323 | 0.80 | NPC1 (0.43) | ATMNPC1RAB9A | |
| SCHEMBL6560431 | 0.78 | ATM (0.51) | ATMNPC1RAB9AMEN1KMT2A | |
| SCHEMBL7156037 | 0.78 | NPC1 (0.46) | ATMNPC1RAB9ACYP3A4 | |
| SCHEMBL8425338 | 0.77 | ATM (0.50) | ATMNPC1RAB9A | |
| SCHEMBL6560715 | 0.76 | ATM (0.56) | ATM | |
| SCHEMBL7287316 | 0.74 | NPC1 (0.44) | ATMNPC1RAB9AMEN1KMT2A | |
| SCHEMBL7286581 | 0.73 | RAB9A (0.42) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL7286566 | 0.73 | RAB9A (0.42) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL8066082 | 0.73 | TRPM8 (0.47) | ATMNPC1RAB9ACYP3A4 |
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-5164371-A | HETEROCYCLIC KETONES | ICI AMERICAS INC. (US) | 1992-11-17 | — | — | US | disclosed |