Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.53 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MTHFD2 | P13995 | 1/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | SLC18A1 | P54219 | 1/20 | 0.40 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24623270 | 0.89 | DRD4 (0.45) | MTNR1AMTNR1BASAH1NPC1LMNA | |
| SCHEMBL22632086 | 0.86 | SLC18A1 (0.45) | ASAH1NPC1LMNATP53MAPK1 | |
| SCHEMBL24623581 | 0.86 | DRD2 (0.48) | MTNR1AMTNR1BASAH1NPC1LMNA | |
| SCHEMBL24623268 | 0.83 | MAPT (0.42) | ASAH1NPC1LMNATP53MAPK1 | |
| SCHEMBL22632226 | 0.78 | MTNR1B (0.60) | MTNR1AMTNR1BHSD17B3ALDH1A1GAA | |
| SCHEMBL22632322 | 0.76 | MTNR1A (0.82) | MTNR1AMTNR1BALDH1A1GAAKDM4E | |
| SCHEMBL22632228 | 0.76 | MTNR1A (0.58) | MTNR1AMTNR1BNPC1LMNAHSD17B3 | |
| SCHEMBL22632306 | 0.72 | MTNR1B (0.53) | MTNR1AMTNR1BHSD17B3ALDH1A1GAA | |
| SCHEMBL15992772 | 0.71 | CHRNA7 (0.49) | MAPK1MTHFD2MAPTALDH1A1GAA | |
| SCHEMBL22632089 | 0.71 | ALDH1A1 (0.67) | MTNR1AMTNR1BNPC1ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020223174-A1 | COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER | HEALTH RESEARCH, INC. (US) | 2020-11-05 | — | — | WO | disclosed |