Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.34 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 7/20 | 0.33 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7953445 | 0.86 | HRH3 (0.43) | CHRM3KDR | |
| SCHEMBL21985038 | 0.80 | MGLL (0.49) | SLC6A4MGLL | |
| Hydrochloric Acid SCHEMBL7954788 | 0.73 | HRH3 (0.45) | KDR | |
| SCHEMBL17910956 | 0.73 | LMNA (0.43) | — | |
| SCHEMBL10267768 | 0.71 | DRD4 (0.48) | — | |
| SCHEMBL13416777 | 0.69 | HSP90AA1 (0.42) | KDR | |
| Hydrochloric Acid SCHEMBL7953408 | 0.67 | HRH3 (0.50) | SLC6A4CHRM3 | |
| SCHEMBL20204779 | 0.66 | MAPT (0.40) | SLC6A4CHRM3KDRFFAR1 | |
| SCHEMBL13452598 | 0.66 | MAOA (0.50) | CHRM3KDR | |
| SCHEMBL3841470 | 0.65 | LMNA (0.40) | — |
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-3436444-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2020-05-13 | — | — | EP | disclosed |