Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLI1 | P08151 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8921056 | 0.79 | DDB1 (0.46) | SRD5A1AKR1C3AKR1C1ALDH1A1SLC18A3 | |
| SCHEMBL5379709 | 0.76 | CA1 (0.44) | ALDH1A1KDM4E | |
| SCHEMBL31147295 | 0.75 | SRD5A1 (0.43) | SRD5A1AKR1C3AKR1C1LMNA | |
| SCHEMBL6551213 | 0.72 | SRD5A1 (0.46) | SRD5A1AKR1C3AKR1C1MAP1LC3BBRD4 | |
| SCHEMBL11701944 | 0.70 | KDM4E (0.46) | SRD5A1AKR1C3AKR1C1MAP1LC3BALDH1A1 | |
| SCHEMBL22321333 | 0.69 | SRD5A1 (0.45) | SRD5A1AKR1C3AKR1C1BRD4LMNA | |
| SCHEMBL18585014 | 0.69 | SRD5A1 (0.49) | SRD5A1AKR1C3AKR1C1BRD4LMNA | |
| SCHEMBL4664194 | 0.69 | TACR1 (0.34) | TACR1MAOAAKR1C3AKR1C1ALDH1A1 | |
| SCHEMBL13039616 | 0.68 | SRD5A1 (0.47) | SRD5A1MAOAAKR1C3AKR1C1CYP3A4 | |
| SCHEMBL4223375 | 0.68 | AR (0.41) | TACR1ALDH1A1GLI1CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6410790-B1 | ANALGESICS | GRUENENTHAL GMBH (DE) | 2002-06-25 | — | — | US | disclosed |