Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3735431 | 0.85 | DRD2 (0.56) | ALDH1A1MAPTLMNAHTTNPC1 | |
| SCHEMBL5899211 | 0.84 | DRD2 (0.57) | ALDH1A1HPGDMAPTLMNAHTT | |
| SCHEMBL27872558 | 0.83 | DRD2 (0.57) | ALDH1A1MAPTLMNAHTTNPC1 | |
| SCHEMBL3220317 | 0.82 | MEN1 (0.51) | ALDH1A1MAPTLMNAHTTNPC1 | |
| SCHEMBL25822238 | 0.82 | RXFP1 (0.52) | ALDH1A1MAPTLMNAHTTNPC1 | |
| SCHEMBL2851575 | 0.81 | RAB9A (0.64) | ALDH1A1MAPTNPC1DRD2SMN1; SMN2 | |
| SCHEMBL981641 | 0.81 | NOTUM (0.60) | ALDH1A1MAPTLMNAHTTNPC1 | |
| SCHEMBL17519898 | 0.80 | HTT (0.47) | ALDH1A1MAPTLMNAHTTNPC1 | |
| SCHEMBL11031260 | 0.79 | HPGD (0.69) | ALDH1A1HPGDHTTNPC1GAA | |
| SCHEMBL14977169 | 0.79 | TDP1 (0.50) | ALDH1A1MAPTLMNAHTTTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998050346-A2 | ACETAMIDE AND UREA DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF CNS DISORDERS | SMITHKLINE BEECHAM PLC (GB) | 1998-11-12 | — | — | WO | disclosed |
| EP-0127634-A1 | PYRROLOCOUMARIN DERIVATIVES, THEIR MANUFACTURE AND UTILISATION | KATHOLIEKE UNIVERSITEIT TE LEUVEN (BE) | 1984-12-12 | — | — | EP | disclosed |
| WO-1984002133-A1 | PYRROLOCOUMARIN DERIVATIVES, THEIR MANUFACTURE AND UTILISATION | UNIV LEUVEN KATH (BE) | 1984-06-07 | — | — | WO | disclosed |