Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 11/20 | 0.78 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.78 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.78 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.78 |
| ▸ | PPARG | P37231 | 2/20 | 0.78 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.78 |
| ▸ | MEN1 | O00255 | 1/20 | 0.78 |
| ▸ | PTGES | O14684 | 1/20 | 0.78 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.78 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.78 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.78 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.78 |
| ▸ | LMNA | P02545 | 1/20 | 0.78 |
| ▸ | ALB | P02768 | 1/20 | 0.78 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.78 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.78 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.78 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.78 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.78 |
| ▸ | AR | P10275 | 1/20 | 0.78 |
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 | |
|---|---|---|---|---|
| SCHEMBL4538035 | 0.90 | PTGS1 (0.83) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL860853 | 0.90 | PTGS2 (0.80) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL13653012 | 0.89 | PTGS2 (0.80) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL13653016 | 0.89 | PTGS2 (0.78) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL17385262 | 0.89 | PTGS2 (0.78) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL23602328 | 0.88 | PTGS2 (0.74) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL15774078 | 0.88 | PTGS2 (0.84) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL5534201 | 0.88 | PTGS2 (0.84) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL14394799 | 0.88 | PTGS2 (0.84) | PTGS2PTGS1AKR1C3AKR1C2PPARG | |
| SCHEMBL7345470 | 0.88 | PTGS1 (0.79) | PTGS2PTGS1AKR1C3AKR1C2PPARG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0537313-B1 | ARYLALKYL ESTERS OF 4,5-DIHYDROXY-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRACENECARBOXYLIC ACID HAVING THERAPEUTICAL ACTIVITY | GENTILI IST SPA (IT) | 1996-01-17 | — | — | EP | disclosed |
| US-5220059-A | An N-amino-, hydroxy or thiocarbonyl or thiocarbonyl, N-hydroxyaminoalkylene derivative | ABBOTT LABORATORIES (US) | 1993-06-15 | — | — | US | disclosed |
| EP-0452908-A2 | Lipoxygenase-inhibiting compounds derived from non-steroidal antiinflammatory carboxylic acids | ABBOTT LABORATORIES (US) | 1991-10-23 | — | — | EP | disclosed |