Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 7/20 | 0.38 |
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | PKM | P14618 | 3/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15377351 | 0.77 | ALOX5 (0.45) | ALOX5RAB9AMAPTNPC1SMN1; SMN2 | |
| SCHEMBL8471659 | 0.75 | ALOX5 (0.31) | ALOX5KIF11 | |
| SCHEMBL9738660 | 0.72 | KDM4E (0.41) | ALOX5RAB9AMAPTNPC1SMN1; SMN2 | |
| SCHEMBL349690 | 0.69 | NOTUM (0.31) | NOTUM | |
| SCHEMBL349740 | 0.67 | ADORA2A (0.31) | — | |
| SCHEMBL5826971 | 0.67 | ALOX5 (0.43) | ALOX5RAB9AMAPTNPC1SMN1; SMN2 | |
| SCHEMBL15677665 | 0.66 | ALOX5 (0.72) | ALOX5RAB9AMAPTNPC1SMN1; SMN2 | |
| SCHEMBL350387 | 0.65 | ADORA2A (0.34) | — | |
| SCHEMBL6216565 | 0.63 | ITGB2 (0.39) | ALOX5MAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL746135 | 0.62 | ALOX5 (0.56) | ALOX5RAB9AMAPTNPC1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0813542-A1 | AMINO ACID HYDROXYETHYLAMINO SULFONAMIDE RETROVIRAL PROTEASE INHIBITORS | G.D. SEARLE & CO. (US) | 1997-12-29 | — | — | EP | disclosed |