Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.44 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.44 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | NOS2 | P35228 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.39 |
| ▸ | TRPC4 | Q9UBN4 | 1/20 | 0.39 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.38 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20764688 | 0.87 | ITGA5 (0.46) | ITGA5ITGB6ITGB8MTORBCHE | |
| SCHEMBL30410775 | 0.87 | ITGA5 (0.46) | ITGA5ITGB6ITGB8MTORBCHE | |
| SCHEMBL30645125 | 0.86 | ITGA5 (0.44) | ITGA5ITGB6ITGB8MTORNPC1 | |
| SCHEMBL22188672 | 0.86 | ITGA5 (0.44) | ITGA5ITGB6ITGB8MTORNPC1 | |
| SCHEMBL20743024 | 0.86 | ITGA5 (0.45) | ITGA5ITGB6ITGB8MTORNPC1 | |
| SCHEMBL20764702 | 0.85 | ITGA5 (0.46) | ITGA5ITGB6ITGB8MTORBCHE | |
| SCHEMBL19283611 | 0.85 | ITGA5 (0.46) | ITGA5ITGB6ITGB8MTORNPC1 | |
| SCHEMBL20792208 | 0.85 | PNMT (0.47) | ITGA5ITGB6ITGB8MTORNPC1 | |
| SCHEMBL20743289 | 0.84 | ITGA5 (0.45) | ITGA5ITGB6ITGB8MTORPKM | |
| Hydrochloric Acid SCHEMBL22321392 | 0.84 | PNMT (0.46) | ITGA5ITGB6ITGB8MTORNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3672953-B1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS POTASSIUM CHANNEL INHIBITORS | ACESION PHARMA APS (DK) | 2021-07-28 | — | — | EP | disclosed |