Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 3/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4723056 | 0.93 | LMNA (0.32) | — | |
| SCHEMBL4721092 | 0.90 | WNT3A (0.30) | — | |
| SCHEMBL4719495 | 0.90 | GSK3B (0.33) | — | |
| SCHEMBL4724170 | 0.90 | P2RX7 (0.32) | NTRK1 | |
| SCHEMBL4720065 | 0.89 | POLB (0.31) | — | |
| SCHEMBL4721894 | 0.89 | PTK2 (0.30) | — | |
| SCHEMBL4766566 | 0.89 | — | — | |
| SCHEMBL4719853 | 0.89 | — | — | |
| SCHEMBL4722031 | 0.88 | PTK2 (0.33) | — | |
| SCHEMBL4719336 | 0.88 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |