Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 2/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.58 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.44 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.44 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.44 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11248851 | 0.93 | AKR1C2 (0.63) | AKR1C2PTGS1AKR1C3KDM4EALDH1A1 | |
| SCHEMBL11243330 | 0.83 | SLC22A12 (0.45) | KDM4EALDH1A1TDP1MAPTPOLB | |
| SCHEMBL11240186 | 0.82 | EDNRA (0.52) | PTPN7DUSP3PTPN12PTPN22PPARG | |
| SCHEMBL11237206 | 0.82 | KDM4E (0.47) | AKR1C2PTGS1AKR1C3KDM4EALDH1A1 | |
| SCHEMBL11246646 | 0.80 | CA2 (0.49) | KDM4EALDH1A1TDP1MAPTPOLB | |
| SCHEMBL11253323 | 0.80 | CYP1A2 (0.47) | AKR1C2PTGS1AKR1C3KDM4EALDH1A1 | |
| SCHEMBL11240017 | 0.79 | KEAP1 (0.51) | KDM4EALDH1A1TDP1MAPTPOLB | |
| SCHEMBL11246422 | 0.79 | KDM4E (0.44) | AKR1C2PTGS1AKR1C3KDM4EALDH1A1 | |
| SCHEMBL11244551 | 0.79 | KDM4E (0.44) | KDM4EALDH1A1TDP1MAPTPOLB | |
| SCHEMBL11243026 | 0.78 | KDM4E (0.41) | AKR1C2PTGS1AKR1C3KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4334078-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIRHEUMATICS | HOFFMANN-LA ROCHE INC. (US) | 1982-06-08 | — | — | US | disclosed |
| US-4219657-A | USED AS ANTIINFLAMATORY AGENTS, ANALGESICS, ANTIRHEUMATIC AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1980-08-26 | — | — | US | disclosed |