Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24769880 | 0.78 | — | — | |
| SCHEMBL24735746 | 0.78 | NPC1 (0.31) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL469525 | 0.77 | — | — | |
| SCHEMBL12363996 | 0.72 | — | — | |
| SCHEMBL3217381 | 0.71 | — | — | |
| SCHEMBL1396798 | 0.70 | — | — | |
| SCHEMBL18090598 | 0.70 | — | — | |
| SCHEMBL12363926 | 0.69 | ANPEP (0.39) | — | |
| SCHEMBL12363899 | 0.69 | ANPEP (0.39) | — | |
| SCHEMBL21099805 | 0.69 | MAPT (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022262789-A1 | ANTITUMOR COMPOUND AND USE THEREOF | 明慧医药（杭州）有限公司 | 2022-12-22 | — | — | WO | disclosed |