Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20705367 | 0.91 | ESR2 (0.50) | ESR2CYP17A1NPSR1HPGDAPP | |
| SCHEMBL20705366 | 0.88 | ESR2 (0.47) | ESR2CYP17A1NPSR1HPGDAPP | |
| SCHEMBL18493839 | 0.86 | HPGD (0.53) | ESR2CYP17A1NPSR1HPGDAPP | |
| SCHEMBL12071483 | 0.85 | GAA (0.47) | ESR2CYP17A1HPGDAPPALDH1A1 | |
| SCHEMBL29416259 | 0.84 | HPGD (0.58) | NPSR1HPGDAPPLMNAALDH1A1 | |
| SCHEMBL4639004 | 0.84 | HPGD (0.58) | NPSR1HPGDAPPLMNAALDH1A1 | |
| SCHEMBL13308526 | 0.84 | HPGD (0.58) | NPSR1HPGDAPPLMNAALDH1A1 | |
| SCHEMBL4423918 | 0.83 | ESR2 (0.46) | ESR2CYP17A1NPSR1HPGDAPP | |
| SCHEMBL15372181 | 0.82 | PLA2G7 (0.43) | ESR2CYP17A1NPSR1HPGDAPP | |
| SCHEMBL17735244 | 0.82 | ESR2 (0.49) | ESR2CYP17A1LMNAALDH1A1MEN1 |
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-10199577-B2 | Electroactive materials | E I DU PONT DE NEMOURS AND COMPANY (US) | 2019-02-05 | — | — | US | disclosed |