Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8781042 | 0.85 | DRD2 (0.50) | AOC3LTA4HMAPK14ALDH1A1LMNA | |
| SCHEMBL8781006 | 0.81 | SYK (0.47) | ABCB1HTR1A | |
| SCHEMBL2652374 | 0.80 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2MAPTMAPK1TDP1 | |
| SCHEMBL18430835 | 0.79 | NISCH (0.55) | ABCB1LTA4HMAPK14ALDH1A1LMNA | |
| SCHEMBL9460724 | 0.76 | HTR1A (0.53) | AOC3LTA4HMAPK14ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL9461010 | 0.75 | HTR1A (0.51) | AOC3LTA4HMAPK14ALDH1A1LMNA | |
| SCHEMBL8781026 | 0.72 | CYP1A2 (0.47) | ABCB1HTR1A | |
| SCHEMBL14614608 | 0.71 | ABCB1 (0.67) | ABCB1ALDH1A1LMNASMN1; SMN2MAPT | |
| SCHEMBL8780987 | 0.71 | CYP1A2 (0.47) | ABCB1HTR1A | |
| SCHEMBL3680376 | 0.71 | AOC3 (0.38) | AOC3SMN1; SMN2 |
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-0773218-A1 | N-(Piperazinylalkoxyphenyl)-N'phenylalkylurea derivatives as ACAT inhibitors for the treatment of atheroschlerosis | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-05-14 | — | — | EP | disclosed |