Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10179124 | 0.82 | MEN1 (0.44) | ESR1ESR2ALDH1A1SLC6A2SLC6A4 | |
| SCHEMBL29163065 | 0.82 | ESR1 (0.56) | ESR1ESR2ALDH1A1HPGDSLC6A2 | |
| SCHEMBL31239238 | 0.82 | ESR1 (0.56) | ESR1ESR2ALDH1A1HPGDSLC6A2 | |
| SCHEMBL24685948 | 0.81 | ESR1 (0.33) | ESR1ESR2CYP17A1MEN1NPC1 | |
| SCHEMBL21164691 | 0.81 | ESR1 (0.46) | ESR1ESR2ALDH1A1HPGDCYP17A1 | |
| SCHEMBL14625003 | 0.80 | ESR1 (0.45) | ESR1ESR2ALDH1A1CYP17A1KDM4E | |
| SCHEMBL24305005 | 0.78 | ESR1 (0.40) | ESR1ESR2HPGDCYP17A1KDM4E | |
| SCHEMBL19286941 | 0.75 | ESR1 (0.40) | ESR1ESR2CYP3A4RIPK1MEN1 | |
| SCHEMBL29328154 | 0.73 | ESR1 (0.40) | ESR1ESR2ALDH1A1CYP17A1KDM4E | |
| SCHEMBL10835512 | 0.73 | ESR1 (0.44) | ESR1ESR2ALDH1A1CYP17A1KDM4E |
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-2012012477-A1 | SUBSTITUTED 3-PHENYL-1,2,4-OXADIAZOLE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-01-26 | — | — | WO | disclosed |