Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 16/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 16/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 16/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 12/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 11/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 9/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 7/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL6132151 | 0.78 | GABRP (0.41) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL8028947 | 0.70 | CA12 (0.44) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL5485097 | 0.69 | TSHR (0.55) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL27536913 | 0.68 | RXRA (0.41) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL286231 | 0.68 | CYP2A6 (0.43) | — | |
| SCHEMBL22032144 | 0.68 | KDM4E (0.40) | — | |
| SCHEMBL17375083 | 0.67 | NPC1 (0.40) | — | |
| SCHEMBL5736404 | 0.67 | CA12 (0.47) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL7726562 | 0.66 | CA12 (0.46) | — | |
| SCHEMBL28646711 | 0.66 | NPC1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000068191-A1 | OXYGEN, SULFUR AND NITROGEN SUBSTITUTED CYCLOHEXENE AND CYCLOHEXANE DERIVATIVES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN SALES, INC. (US) | 2000-11-16 | — | — | WO | disclosed |