Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 15/20 | 0.35 |
| ▸ | F2 | P00734 | 12/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5229345 | 0.89 | EGFR (0.34) | ALDH1A1KMT2A | |
| SCHEMBL5222928 | 0.85 | SMO (0.38) | ALDH1A1KMT2A | |
| SCHEMBL5226173 | 0.85 | SMO (0.38) | ALDH1A1NPC1KMT2A | |
| SCHEMBL5226844 | 0.85 | SIGMAR1 (0.34) | ALDH1A1KMT2A | |
| SCHEMBL5226667 | 0.85 | DRD4 (0.39) | ALDH1A1KMT2A | |
| SCHEMBL5225471 | 0.82 | HRH3 (0.35) | LTA4HCD274 | |
| SCHEMBL5230408 | 0.81 | SLC2A1 (0.32) | ALDH1A1PDCD1CD274 | |
| SCHEMBL5226446 | 0.81 | ALDH1A1 (0.41) | ALDH1A1NPC1KMT2APDCD1CD274 | |
| SCHEMBL5229304 | 0.80 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL5228505 | 0.79 | F10 (0.48) | F10F2 |
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-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |