Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 12/20 | 0.87 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4407571 | 0.93 | GABRA5 (1.00) | GABRA5ALDH1A1LMNAHTTCHRM4 | |
| SCHEMBL4410068 | 0.85 | GABRA5 (1.00) | GABRA5ITGA5ALDH1A1LMNAHTT | |
| SCHEMBL4402982 | 0.76 | GABRA5 (1.00) | GABRA5CHRM4PPARDPPARA | |
| SCHEMBL2683793 | 0.75 | GABRA5 (1.00) | GABRA5CNR1ALDH1A1NPC1RAB9A | |
| SCHEMBL2683802 | 0.75 | GABRA5 (1.00) | GABRA5CNR1ALDH1A1NPC1RAB9A | |
| SCHEMBL2683796 | 0.74 | GABRA5 (0.75) | GABRA5ALDH1A1LMNATSHRPPARA | |
| SCHEMBL2685284 | 0.73 | GABRA5 (0.77) | GABRA5ALDH1A1NPC1RAB9A | |
| SCHEMBL2685279 | 0.73 | GABRA5 (0.77) | GABRA5ALDH1A1NPC1RAB9A | |
| SCHEMBL16290095 | 0.72 | GABRA5 (0.76) | GABRA5ITGA5ALDH1A1RAB9A | |
| SCHEMBL2689993 | 0.71 | GABRA5 (0.65) | GABRA5ITGA5 |
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-2012062623-A1 | TRIAZOLE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-05-18 | — | — | WO | disclosed |