Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18501582 | 1.00 | NPC1 (0.31) | NPC1RAB9A | |
| SCHEMBL18506549 | 0.85 | — | — | |
| SCHEMBL18923564 | 0.77 | — | — | |
| SCHEMBL18506450 | 0.74 | KMT2A (0.35) | — | |
| SCHEMBL18923678 | 0.73 | — | — | |
| SCHEMBL18506478 | 0.71 | — | — | |
| SCHEMBL18506557 | 0.66 | KMT2A (0.33) | — | |
| SCHEMBL18334084 | 0.66 | CRBN (0.36) | — | |
| SCHEMBL18506490 | 0.65 | — | — | |
| SCHEMBL18501595 | 0.62 | — | — |
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-9670226-B2 | Sesquiterpenoids | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2017-06-06 | — | — | US | disclosed |