Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7282165 | 0.88 | S1PR1 (0.48) | S1PR1ITGB3ITGA2BHDAC1RXRA | |
| SCHEMBL7280838 | 0.86 | HDAC1 (0.44) | S1PR1HDAC1EPHX2PPARDPPARA | |
| SCHEMBL7275491 | 0.82 | S1PR1 (0.52) | S1PR1ITGB3ITGA2BHDAC1RXRA | |
| SCHEMBL7275097 | 0.82 | S1PR1 (0.52) | S1PR1ITGB3ITGA2BHDAC1RXRA | |
| SCHEMBL7396722 | 0.80 | S1PR1 (0.52) | S1PR1ITGB3ITGA2BHDAC1PPARD | |
| SCHEMBL7285127 | 0.80 | S1PR1 (0.50) | S1PR1ITGB3ITGA2BHDAC1RXRA | |
| SCHEMBL7273941 | 0.79 | HDAC1 (0.53) | S1PR1ITGB3ITGA2BHDAC1RXRA | |
| SCHEMBL7274246 | 0.79 | S1PR1 (0.52) | S1PR1ITGB3ITGA2BHDAC1RXRA | |
| Propylamine SCHEMBL8911584 | 0.79 | S1PR1 (0.55) | S1PR1ITGB3ITGA2BRXRARXRB | |
| SCHEMBL7274080 | 0.78 | ITGB3 (0.74) | S1PR1ITGB3ITGA2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5650424-A | ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES | DR. KARL THOMAE GMBH (DE) | 1997-07-22 | — | — | US | disclosed |
| EP-0503548-B1 | Cyclic urea derivatives, medicaments contaning them and process for their preparation | THOMAE GMBH DR K (DE) | 1997-06-04 | — | — | EP | disclosed |
| US-5478942-A | Antiinflammatory agents, antiagglomerants | KARL THOMAE GMBH (DE) | 1995-12-26 | — | — | US | disclosed |
| US-5276049-A | Treatment of thrombosis | DR. KARL THOMAE GMBH (DE) | 1994-01-04 | — | — | US | disclosed |
| EP-0503548-A1 | Cyclic urea derivatives, medicaments contaning them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1992-09-16 | — | — | EP | disclosed |