Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | LPL | P06858 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5668728 | 0.78 | PTGS1 (0.41) | PTGS2PTGS1ALDH1A1GAALPL | |
| Sulfamide SCHEMBL4639024 | 0.70 | PTGS2 (0.45) | PTGS2PTGS1LMNAGAAHTT | |
| SCHEMBL8621773 | 0.70 | PTGS2 (0.48) | PTGS2PTGS1NPSR1ALDH1A1LMNA | |
| SCHEMBL9845357 | 0.69 | OPRD1 (0.45) | ALDH1A1KDM4EHPGD | |
| SCHEMBL9745003 | 0.67 | SIGMAR1 (0.37) | PTGS2PTGS1NPSR1ALDH1A1KDM4E | |
| SCHEMBL14485126 | 0.66 | PTGS1 (0.41) | PTGS2PTGS1ALDH1A1LPLLIPG | |
| SCHEMBL8834868 | 0.65 | ALDH1A1 (0.42) | PTGS2SLC6A4ALDH1A1PGRLPL | |
| SCHEMBL851339 | 0.64 | PTGS2 (0.71) | PTGS2PTGS1 | |
| SCHEMBL3569651 | 0.64 | ALDH1A1 (0.65) | PTGS2SLC6A4SLC6A3PTGS1NPSR1 | |
| SCHEMBL214628 | 0.63 | PTGS2 (0.56) | PTGS2PTGS1 |
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-5114964-A | Aryl-substituted benzocycloalkyl-derived anti-atherosclerotic agents | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1992-05-19 | — | — | US | disclosed |