Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 5/20 | 0.50 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.41 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 8/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7879430 | 0.81 | PIK3CD (0.45) | PIK3CDLTA4HMAP4K4CYP1A2KCNH2 | |
| SCHEMBL12772953 | 0.77 | MTOR (0.41) | CYP1A2KCNH2MTOR | |
| SCHEMBL6894053 | 0.76 | PIK3CD (0.50) | PIK3CDLTA4HNOS3NOS2MAP4K4 | |
| SCHEMBL4502030 | 0.76 | PIK3CD (0.46) | PIK3CDLTA4HNOS3NOS2MAP4K4 | |
| SCHEMBL30522558 | 0.74 | NOS3 (0.48) | PIK3CDLTA4HNOS3NOS2MAP4K4 | |
| SCHEMBL30522547 | 0.74 | MTOR (0.52) | PIK3CDNOS3NOS2MTORCCNE1 | |
| SCHEMBL7872340 | 0.74 | MTOR (0.55) | MTORCCNE1CDK2 | |
| SCHEMBL12138047 | 0.73 | PIK3CD (0.47) | PIK3CDLTA4HNOS3NOS2MAP4K4 | |
| SCHEMBL29535066 | 0.73 | PIK3CD (0.44) | PIK3CDLTA4HNOS3NOS2MAP4K4 | |
| SCHEMBL12773470 | 0.70 | MTOR (0.67) | PIK3CDMAP4K4KCNH2MINK1MTOR |
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-2010122069-A1 | 5-ALKYNYL-PYRIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-10-28 | — | — | WO | disclosed |