Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4D | Q6B0I6 | 3/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | CKS1B | P61024 | 1/20 | 0.33 |
| ▸ | SKP1 | P63208 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | BUB1 | O43683 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8697195 | 0.82 | ROCK2 (0.38) | ROCK2ITGB3ITGA2BALDH1A1GAA | |
| SCHEMBL8686282 | 0.80 | ROCK2 (0.35) | ROCK2ITGB3ITGA2BALDH1A1TSHR | |
| SCHEMBL7450096 | 0.74 | ITGB3 (0.42) | ROCK2ITGB3ITGA2BALDH1A1TSHR | |
| SCHEMBL8698839 | 0.74 | FAAH (0.37) | ITGB3ITGA2BALDH1A1GAATSHR | |
| SCHEMBL8630686 | 0.73 | ITGB3 (0.37) | ROCK2ITGB3ITGA2BALDH1A1TSHR | |
| SCHEMBL7398021 | 0.72 | ITGB3 (0.39) | ROCK2ITGB3ITGA2BALDH1A1TSHR | |
| SCHEMBL8699716 | 0.71 | F10 (0.36) | ITGB3ITGA2BALDH1A1GAATSHR | |
| SCHEMBL8635810 | 0.71 | NPSR1 (0.34) | ITGB3ITGA2BKMT2AALDH1A1GAA | |
| SCHEMBL7403452 | 0.70 | ITGB3 (0.37) | ITGB3ITGA2BALDH1A1TSHRF10 | |
| SCHEMBL8634865 | 0.69 | GAA (0.38) | ROCK2KMT2AL3MBTL1GAATSHR |
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-5753659-A | ANTICOAGULANTS FOR BLOOD DISORDER, CARDIOVASCULAR DISORDER, THROMBOSIS, | ZENECA LIMITED (GB) | 1998-05-19 | — | — | US | disclosed |