Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 3/20 | 0.47 |
| ▸ | PPARG | P37231 | 4/20 | 0.41 |
| ▸ | PPARD | Q03181 | 3/20 | 0.41 |
| ▸ | PPARA | Q07869 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | F7 | P08709 | 2/20 | 0.41 |
| ▸ | F3 | P13726 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11451513 | 1.00 | TOP1 (0.47) | TOP1PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL11573698 | 1.00 | TOP1 (0.47) | TOP1PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL1083217 | 1.00 | TOP1 (0.47) | TOP1PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL1083220 | 1.00 | TOP1 (0.47) | TOP1PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL17421815 | 1.00 | TOP1 (0.47) | TOP1PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL10686186 | 0.94 | ALDH1A1 (0.43) | TOP1PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL11216573 | 0.89 | TOP1 (0.35) | TOP1PTGER2TBXA2R | |
| SCHEMBL11182020 | 0.87 | TOP1 (0.33) | TOP1 | |
| SCHEMBL11595519 | 0.84 | PTGER2 (0.37) | PPARGALDH1A1OXER1KDM4ETDP1 | |
| SCHEMBL9460671 | 0.84 | PTGER2 (0.37) | PPARGALDH1A1OXER1KDM4ETDP1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4321405-A | HYPOTENSIVE AGENTS, BRONCHODILATORS, ANTISECRETORY AGENTS | AMERICAN CYANAMID COMPANY (US) | 1982-03-23 | — | — | US | disclosed |
| US-4219664-A | BRONCHODILATORS, HYPOTENSIVE AGENTS, GASTRIC ACID SECRETION INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 1980-08-26 | — | — | US | disclosed |
| US-4194055-A | PROSTAGLANDINS, BRONCHODILATORS, ANTIINFLAMMATORY, HYPOTSENSIVE, ANTIULCER | AMERICAN CYANAMID COMPANY (US) | 1980-03-18 | — | — | US | disclosed |
| US-4113967-A | BRONCHODILATORS, HYPOTENSIVE, ANTISECRETORY | AMERICAN CYANAMID COMPANY (US) | 1978-09-12 | — | — | US | disclosed |
| US-4111959-A | BRONCHODILATORS, ANTIINFLAMMATORY, HYPOTENSIVE, ANTISECRETORY | AMERICAN CYANAMID COMPANY (US) | 1978-09-05 | — | — | US | disclosed |
| US-4087621-A | 7-{3-Hydroxy-2β-[4-hydroxy-4-(lower alkyl)-trans-1-octen-1-yl]-5-oxocyclopent-1α-yl}hept-5-cis-enoic acids and related compounds | G. D. SEARLE & CO. (US) | 1978-05-02 | — | — | US | disclosed |