Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | GAA | P10253 | 1/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.51 |
| ▸ | F10 | P00742 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | DPP4 | P27487 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | F13A1 | P00488 | 1/20 | 0.47 |
| ▸ | TGM2 | P21980 | 1/20 | 0.47 |
| ▸ | TGM1 | P22735 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | CTSL | P07711 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7327865 | 1.00 | ALDH1A1 (0.66) | ALDH1A1GAATSHRPOLBGLA | |
| SCHEMBL4715295 | 0.85 | ALDH1A1 (0.67) | ALDH1A1GAATSHRPOLBEPHX1 | |
| SCHEMBL4715296 | 0.85 | ALDH1A1 (0.67) | ALDH1A1GAATSHRPOLBEPHX1 | |
| SCHEMBL1554397 | 0.84 | POLB (0.60) | ALDH1A1GAATSHRPOLBGLA | |
| SCHEMBL1554396 | 0.84 | POLB (0.60) | ALDH1A1GAATSHRPOLBGLA | |
| SCHEMBL2468733 | 0.83 | POLB (0.58) | ALDH1A1GAAPOLBGLAF10 | |
| SCHEMBL3414618 | 0.83 | POLB (0.58) | ALDH1A1GAAPOLBGLAF10 | |
| Hydrochloric Acid SCHEMBL7389872 | 0.82 | POLB (0.57) | ALDH1A1GAAPOLBGLAF10 | |
| SCHEMBL2468732 | 0.82 | ROCK2 (0.58) | ALDH1A1GAATSHRPOLBGLA | |
| SCHEMBL3948461 | 0.81 | ALDH1A1 (0.85) | ALDH1A1GAATSHREPHX1KCNH2 |
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-0370498-A2 | Trans-4-amino(alkyl)-1-pyridylcarbamoylcyclohexane compounds and pharmaceutical use thereof | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1990-05-30 | — | — | EP | disclosed |