Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | AVPR1A | P37288 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2548368 | 0.99 | SLC6A3 (0.34) | SLC6A3GRM2CHRM4CHRM1CHRM2 | |
| Hydrochloric Acid SCHEMBL2544777 | 0.83 | AVPR1A (0.33) | AVPR1A | |
| SCHEMBL2566668 | 0.81 | AVPR1A (0.33) | AVPR1A | |
| Hydrochloric Acid SCHEMBL2567137 | 0.81 | AVPR1A (0.39) | AVPR1A | |
| SCHEMBL2548383 | 0.80 | MAPT (0.37) | SLC6A3GRM2CHRM4CHRM1CHRM2 | |
| SCHEMBL2559627 | 0.80 | CCNT1 (0.38) | — | |
| Hydrochloric Acid SCHEMBL2556061 | 0.80 | CCNT1 (0.38) | — | |
| Hydrochloric Acid SCHEMBL2549432 | 0.80 | RBP4 (0.32) | — | |
| Hydrochloric Acid SCHEMBL2472292 | 0.79 | HSD11B1 (0.31) | AVPR1A | |
| SCHEMBL2563306 | 0.79 | AVPR1A (0.35) | AVPR1A |
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-2552919-A1 | ARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. Hoffmann-La Roche AG (CH) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011120877-A1 | ARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-06 | — | — | WO | disclosed |