Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9254094 | 0.88 | F2 (0.37) | PDK1NPC1RAB9A | |
| SCHEMBL8863938 | 0.86 | TMPRSS15 (0.36) | PDK1NPC1RAB9A | |
| SCHEMBL9257803 | 0.86 | MAPT (0.35) | — | |
| SCHEMBL9254355 | 0.83 | PDK1 (0.35) | PDK1NPC1 | |
| SCHEMBL9568440 | 0.82 | ITGB3 (0.39) | PDK1 | |
| SCHEMBL9250531 | 0.82 | F2 (0.35) | PDK1 | |
| SCHEMBL9251525 | 0.81 | MIF (0.37) | PDK1NPC1 | |
| SCHEMBL9254692 | 0.80 | F10 (0.34) | PDK1 | |
| SCHEMBL9253978 | 0.79 | ITGB3 (0.37) | PDK1 | |
| SCHEMBL9255067 | 0.77 | PDK1 (0.33) | PDK1NPC1RAB9A |
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-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0525629-A2 | 5-membered heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-02-03 | — | — | EP | disclosed |