Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 4/20 | 0.35 |
| ▸ | RXRB | P28702 | 2/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.33 |
| ▸ | RARA | P10276 | 4/20 | 0.33 |
| ▸ | RARB | P10826 | 4/20 | 0.33 |
| ▸ | RARG | P13631 | 4/20 | 0.33 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.31 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9419007 | 0.89 | RXRA (0.35) | RXRARXRBKARS1RARARARB | |
| SCHEMBL9418950 | 0.77 | RXRA (0.51) | RXRARXRBRARARARBRARG | |
| SCHEMBL9863066 | 0.75 | CYP2D6 (0.36) | NAMPTKARS1UGT2B7LMNA | |
| SCHEMBL3541162 | 0.73 | RXRA (0.58) | RXRARXRBRARARARBRARG | |
| SCHEMBL8735903 | 0.73 | KARS1 (0.40) | RXRARXRBKARS1UGT2B7CCNE1 | |
| SCHEMBL9418955 | 0.72 | KARS1 (0.42) | RXRARXRBKARS1CCNE1CDK2 | |
| SCHEMBL8732926 | 0.71 | RXRA (0.40) | RXRARXRBKARS1RARARARB | |
| SCHEMBL9419032 | 0.70 | RXRA (0.38) | RXRARXRBKARS1RARARARB | |
| SCHEMBL11438868 | 0.69 | HPGD (0.36) | RXRARXRBKARS1CCNE1CDK2 | |
| SCHEMBL31003100 | 0.69 | RXRA (0.40) | RXRARXRBKARS1RARARARB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0315071-B1 | Benzocyclohepten derivatives, their preparation and utilisation for pharmaceutics | HOFFMANN LA ROCHE (CH) | 1994-07-20 | — | — | EP | disclosed |
| EP-0315071-A2 | Benzocyclohepten derivatives, their preparation and utilisation for pharmaceutics | F. HOFFMANN-LA ROCHE AG (CH) | 1989-05-10 | — | — | EP | disclosed |