Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 3/20 | 0.45 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10628341 | 1.00 | PDK1 (0.45) | PDK1EPHA2KDRHRH3NOTUM | |
| SCHEMBL10631542 | 0.88 | DRD4 (0.41) | — | |
| SCHEMBL9529387 | 0.87 | HRH3 (0.56) | PDK1HRH3NOTUMALDH1A1 | |
| SCHEMBL9528227 | 0.87 | HRH3 (0.56) | PDK1HRH3NOTUMALDH1A1 | |
| SCHEMBL10634373 | 0.85 | DRD4 (0.59) | — | |
| SCHEMBL10634378 | 0.85 | DRD4 (0.59) | — | |
| SCHEMBL9528632 | 0.83 | HTR2A (0.51) | NOTUMALDH1A1 | |
| SCHEMBL9528638 | 0.83 | HTR2A (0.51) | NOTUMALDH1A1 | |
| SCHEMBL10628006 | 0.83 | PDK1 (0.44) | PDK1EPHA2KDRHRH3 | |
| SCHEMBL10628010 | 0.83 | PDK1 (0.44) | PDK1EPHA2KDRHRH3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4782054-A | ANTIISCHEMIC, ANTIHYPOXIC, STIMULANTS | ADIR ET COMPAGNIE (FR) | 1988-11-01 | — | — | US | disclosed |