Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8724532 | 1.00 | RARB (0.41) | RARBLMNANR5A1CYP3A4CYP2D6 | |
| SCHEMBL10550758 | 0.88 | ALDH1A1 (0.40) | LMNACYP2D6LTA4HMAPTRAB9A | |
| SCHEMBL10555841 | 0.87 | LMNA (0.39) | LMNANR5A1CYP2D6S1PR3MAPT | |
| SCHEMBL10557632 | 0.86 | RAB9A (0.39) | LMNACYP2D6MAPTRAB9ACRBN | |
| SCHEMBL8829223 | 0.85 | CNR2 (0.37) | LMNACYP3A4MAPT | |
| SCHEMBL10555395 | 0.84 | SLC6A2 (0.39) | LMNAMAPTRAB9A | |
| SCHEMBL10557210 | 0.83 | SLC6A2 (0.37) | LMNAMAPTRAB9ACRBN | |
| SCHEMBL8729800 | 0.82 | RARB (0.46) | RARBLMNANR5A1CYP3A4CYP2D6 | |
| SCHEMBL10557955 | 0.82 | RAB9A (0.51) | RARBLMNANR5A1CYP3A4CYP2D6 | |
| SCHEMBL8731567 | 0.82 | RARB (0.46) | RARBLMNANR5A1CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5853613-A | Chiral cyclohexyl compounds | SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) | 1998-12-29 | — | — | US | disclosed |