Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.46 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.46 |
| ▸ | CACNG2 | Q9Y698 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14363289 | 0.97 | ESR2 (0.57) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL25769073 | 0.97 | ESR2 (0.57) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL26343636 | 0.97 | ESR1 (0.53) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL25668036 | 0.96 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL14000274 | 0.96 | ESR2 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL26343739 | 0.96 | ESR1 (0.55) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL26345247 | 0.95 | ESR1 (0.49) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL14000373 | 0.95 | ESR1 (0.48) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL12887915 | 0.95 | ESR1 (0.51) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL18999481 | 0.95 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 |
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-2020040434-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-02-27 | — | — | WO | disclosed |