Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | CCR5 | P51681 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.36 |
| ▸ | MEP1A | Q16819 | 1/20 | 0.35 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.35 |
| ▸ | ACSL1 | P33121 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | VNN1 | O95497 | 1/20 | 0.35 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6964408 | 0.76 | ALDH1A1 (0.43) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 | |
| SCHEMBL6972441 | 0.75 | ALDH1A1 (0.43) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 | |
| SCHEMBL6968547 | 0.75 | ALDH1A1 (0.42) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 | |
| SCHEMBL6973145 | 0.74 | ALDH1A1 (0.40) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 | |
| SCHEMBL6973013 | 0.74 | ALDH1A1 (0.40) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 | |
| SCHEMBL6969060 | 0.73 | ALDH1A1 (0.40) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 | |
| SCHEMBL6960549 | 0.72 | MAPT (0.38) | SLC6A2SLC6A4SLC6A3ALDH1A1MAPT | |
| SCHEMBL6971588 | 0.71 | PDE9A (0.47) | ALDH1A1MAPTVNN1 | |
| SCHEMBL6971488 | 0.71 | ADAMTS4 (0.39) | SLC6A2SLC6A4SLC6A3ALDH1A1MAPT | |
| SCHEMBL6967065 | 0.71 | ALDH1A1 (0.36) | SLC6A2SLC6A4SLC6A3CCR5ALDH1A1 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |