Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 1.00 |
| ▸ | SERPINA6 | P08185 | 2/20 | 1.00 |
| ▸ | SHBG | P04278 | 2/20 | 1.00 |
| ▸ | SLC22A1 | O15245 | 1/20 | 1.00 |
| ▸ | THRB | P10828 | 1/20 | 1.00 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.70 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.70 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.70 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.70 |
| ▸ | AR | P10275 | 1/20 | 0.69 |
| ▸ | ESR1 | P03372 | 2/20 | 0.66 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.66 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 4/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Nandrolone SCHEMBL28638525 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL28993612 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL11872554 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL11977556 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL5021656 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL17831191 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL5017882 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL12101449 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL22739132 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL7266056 | 1.00 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4044004-A | Total steroid synthesis employing substituted isoxazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 1977-08-23 | — | — | US | disclosed |
| US-3984428-A | Isoxazolyl-substituted perhydrobenzindenes | HOFFMANN-LA ROCHE INC. (US) | 1976-10-05 | — | — | US | disclosed |