Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 4/20 | 0.35 |
| ▸ | RXRB | P28702 | 2/20 | 0.35 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 4/20 | 0.33 |
| ▸ | RARB | P10826 | 4/20 | 0.33 |
| ▸ | RARG | P13631 | 4/20 | 0.33 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.31 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.30 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL9419042 | 0.89 | RXRA (0.35) | RXRARXRBNOX1LMNARARA | |
| SCHEMBL29756195 | 0.77 | ACHE (0.33) | ACHECYP3A4 | |
| SCHEMBL9418950 | 0.77 | RXRA (0.51) | RXRARXRBNOX1RARARARB | |
| SCHEMBL8732926 | 0.74 | RXRA (0.40) | RXRARXRBNOX1RARARARB | |
| SCHEMBL3541162 | 0.73 | RXRA (0.58) | RXRARXRBRARARARBRARG | |
| SCHEMBL9419032 | 0.73 | RXRA (0.38) | RXRARXRBNOX1RARARARB | |
| SCHEMBL9863066 | 0.72 | CYP2D6 (0.36) | LMNAUGT2B7KARS1 | |
| SCHEMBL31085264 | 0.70 | RXRA (0.41) | RXRARXRBNOX1RARARARB | |
| SCHEMBL8735903 | 0.70 | KARS1 (0.40) | RXRARXRBLMNAUGT2B7CYP3A4 | |
| SCHEMBL9418955 | 0.69 | KARS1 (0.42) | RXRARXRBLMNACYP3A4KARS1 |
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-0315071-B1 | Benzocyclohepten derivatives, their preparation and utilisation for pharmaceutics | HOFFMANN LA ROCHE (CH) | 1994-07-20 | — | — | EP | disclosed |
| US-4992574-A | Skin disorders, antiallergens, antiinflammatory agent | HOFFMANN-LA ROCHE INC. (US) | 1991-02-12 | — | — | US | disclosed |
| EP-0315071-A2 | Benzocyclohepten derivatives, their preparation and utilisation for pharmaceutics | F. HOFFMANN-LA ROCHE AG (CH) | 1989-05-10 | — | — | EP | disclosed |