Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 4/20 | 0.32 |
| ▸ | RARB | P10826 | 4/20 | 0.32 |
| ▸ | RARG | P13631 | 4/20 | 0.32 |
| ▸ | RXRA | P19793 | 3/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL9250327 | 1.00 | AKR1C3 (0.47) | AKR1C3TBXAS1HTTAPEX1PKM | |
| SCHEMBL8747842 | 1.00 | AKR1C3 (0.47) | AKR1C3TBXAS1HTTAPEX1PKM | |
| SCHEMBL9244065 | 0.83 | MAPT (0.44) | HTTPKMMAPK1KDM4ENPC1 | |
| SCHEMBL9244062 | 0.83 | MAPT (0.44) | HTTPKMMAPK1KDM4ENPC1 | |
| SCHEMBL9250285 | 0.75 | CA1 (0.44) | RARBRARGRXRACYP26A1ALDH1A1 | |
| SCHEMBL2462983 | 0.74 | AKR1C3 (0.82) | AKR1C3TBXAS1HTTAPEX1KDM4E | |
| SCHEMBL2462984 | 0.74 | AKR1C3 (0.82) | AKR1C3TBXAS1HTTAPEX1KDM4E | |
| SCHEMBL9248972 | 0.72 | CA2 (0.42) | AKR1C3HTTRXRAHSD11B1KDM4E | |
| SCHEMBL1237224 | 0.70 | AKR1C3 (0.62) | AKR1C3APEX1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL20500020 | 0.70 | AKR1C3 (0.62) | AKR1C3APEX1KDM4EALDH1A1CYP1A2 |
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-0599732-B1 | Derivatives of 1-phenylbicyclo-2,2,2-octane, their preparation process and pharmaceutical compositions containing them | ADIR (FR) | 1997-03-12 | — | — | EP | disclosed |
| US-5403953-A | Antiarthritic and -inflammatory agents | ADIR ET COMPAGNIE (FR) | 1995-04-04 | — | — | US | disclosed |
| EP-0599732-A1 | Derivatives of 1-phenylbicyclo-2,2,2-octane, their preparation process and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1994-06-01 | — | — | EP | disclosed |