Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.72 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.72 |
| ▸ | SHBG | P04278 | 2/20 | 0.72 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.72 |
| ▸ | THRB | P10828 | 1/20 | 0.72 |
| ▸ | PGR | P06401 | 2/20 | 0.61 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.53 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17209910 | 0.88 | SHBG (0.72) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Oxendolone SCHEMBL10380170 | 0.86 | PGR (0.74) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Oxendolone SCHEMBL1650323 | 0.86 | PGR (0.74) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Oxendolone SCHEMBL233297 | 0.86 | PGR (0.74) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Oxendolone SCHEMBL12826307 | 0.86 | PGR (0.74) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| SCHEMBL10626927 | 0.86 | ALDH1A1 (0.69) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| SCHEMBL10380864 | 0.84 | PGR (0.66) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL12101449 | 0.84 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL22739132 | 0.84 | ALDH1A1 (1.00) | ALDH1A1SERPINA6SHBGSLC22A1THRB | |
| Nandrolone SCHEMBL11736454 | 0.84 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4780420-A | MEDICAL DIAGNOSIS | YALE UNIVERSITY (US) | 1988-10-25 | — | — | US | disclosed |