Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.35 |
| ▸ | GRK2 | P25098 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.33 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.33 |
| ▸ | KLK1 | P06870 | 3/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 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 SCHEMBL10689236 | 0.99 | NPC1 (0.36) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL10692353 | 0.78 | NPC1 (0.42) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL10688108 | 0.75 | HTT (0.37) | NPC1RAB9AALDH1A1GAASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL10511632 | 0.72 | MAPT (0.51) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL10690068 | 0.71 | KDM4E (0.38) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL10693756 | 0.68 | AAK1 (0.42) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL4454948 | 0.68 | KLK1 (0.63) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL10695809 | 0.68 | AAK1 (0.41) | NPC1MAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL10687930 | 0.68 | ROCK2 (0.41) | ROCK2GRK2GAAKLK1KLK5 | |
| SCHEMBL10693217 | 0.67 | CYP1A2 (0.40) | NPC1MAPTRAB9ALMNAALDH1A1 |
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-0252507-A1 | 2-(4-Pyridylaminomethyl)-benzimidazole derivatives having antiviral activity | Maruishi Seiyaku Kabushiki Kaisha (JP) | 1988-01-13 | — | — | EP | disclosed |