Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.47 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GCK | P35557 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | GPR132 | Q9UNW8 | 3/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8781095 | 0.85 | ABCB1 (0.46) | HTR1ASGMS2ALDH1A1LMNAIKBKB | |
| SCHEMBL806892 | 0.81 | HTR1A (0.57) | DRD2HTR1ASLC1A5SGMS2ALDH1A1 | |
| SCHEMBL8781006 | 0.77 | SYK (0.47) | DRD2HTR1ASLC1A5CYP1A2GCK | |
| SCHEMBL2652374 | 0.77 | ALDH1A1 (0.50) | CYP1A2ALDH1A1POLB | |
| SCHEMBL9460724 | 0.73 | HTR1A (0.53) | DRD2HTR1ASGMS2CYP1A2ALDH1A1 | |
| SCHEMBL21465845 | 0.73 | HTR1A (0.61) | DRD2HTR1ASLC1A5SGMS2ALDH1A1 | |
| SCHEMBL1028598 | 0.73 | HTR1A (0.61) | DRD2HTR1ASLC1A5SGMS2CYP1A2 | |
| SCHEMBL8130463 | 0.73 | HTR1A (0.61) | DRD2HTR1ASLC1A5SGMS2ALDH1A1 | |
| SCHEMBL15084393 | 0.73 | HTR1A (0.61) | DRD2HTR1AALDH1A1POLBGCK | |
| Hydrochloric Acid SCHEMBL9461010 | 0.72 | HTR1A (0.51) | DRD2HTR1ASGMS2CYP1A2ALDH1A1 |
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 |