Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 12/20 | 0.52 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 5/20 | 0.46 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7572567 | 0.90 | LCK (0.53) | LCKMKNK2MKNK1PROKR1 | |
| SCHEMBL7515352 | 0.88 | LCK (0.67) | LCKMKNK2MKNK1 | |
| SCHEMBL7506273 | 0.85 | LCK (0.67) | LCKMKNK2MKNK1 | |
| SCHEMBL7588831 | 0.84 | LCK (0.69) | LCK | |
| SCHEMBL7506804 | 0.83 | LCK (0.53) | LCKMKNK2MKNK1ROCK1 | |
| SCHEMBL7570454 | 0.82 | LCK (0.62) | LCKMKNK2MKNK1 | |
| SCHEMBL7579941 | 0.81 | LCK (0.43) | LCKMKNK2MKNK1ROCK1 | |
| SCHEMBL7505588 | 0.80 | LCK (0.62) | LCKMKNK2MKNK1 | |
| SCHEMBL7506519 | 0.79 | LCK (0.64) | LCK | |
| SCHEMBL7507028 | 0.77 | MKNK1 (0.55) | LCKMKNK2MKNK1ROCK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6329380-B1 | PYRIMIDINE BENZIMIDIZAZOLE, PYRIMIDINEIMIDAZOLE OR PYRIDINE IMIDAZOLE COMPOUNDS FOR ANTICANCER AGENTS OR ATHEROSCLEROSIS | MERCK & CO., INC. | 2001-12-11 | — | — | US | claimed |
| US-6329380-B1 | PYRIMIDINE BENZIMIDIZAZOLE, PYRIMIDINEIMIDAZOLE OR PYRIDINE IMIDAZOLE COMPOUNDS FOR ANTICANCER AGENTS OR ATHEROSCLEROSIS | MERCK & CO., INC. | 2001-12-11 | — | — | US | disclosed |