Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 7/20 | 0.35 |
| ▸ | PPARA | Q07869 | 7/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | SCTR | P47872 | 1/20 | 0.34 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL23206314 | 0.99 | CA12 (0.36) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL23057396 | 0.84 | EPHX2 (0.43) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL23195209 | 0.81 | ALDH1A1 (0.39) | CA1CA2CA9KDM4ERAB9A | |
| SCHEMBL22815335 | 0.81 | ALDH1A1 (0.42) | CYP3A4ALDH1A1HPGDALOX15TSHR | |
| SCHEMBL25568540 | 0.81 | EPHX2 (0.38) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL25569696 | 0.80 | HDAC8 (0.38) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL10136271 | 0.77 | HDAC8 (0.54) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL29405564 | 0.77 | HDAC8 (0.54) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL30800492 | 0.75 | CA12 (0.54) | HDAC8HDAC6PPARGPPARACA12 | |
| SCHEMBL23232067 | 0.75 | CA12 (0.54) | HDAC8HDAC6PPARGPPARACA12 |
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-2021066350-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-04-08 | — | — | WO | disclosed |