Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.49 |
| ▸ | ESR1 | P03372 | 4/20 | 0.49 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 2/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 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 | |
|---|---|---|---|---|
| SCHEMBL26489807 | 0.94 | HDAC8 (0.51) | HDAC4HDAC2HDAC8ESR2ESR1 | |
| SCHEMBL23943223 | 0.90 | HDAC4 (0.41) | HDAC4HDAC2HDAC8ESR2ESR1 | |
| SCHEMBL17452020 | 0.88 | MCL1 (0.44) | HDAC4HDAC2HDAC8ACMSDMCL1 | |
| SCHEMBL21906649 | 0.84 | ESR1 (0.40) | HDAC4HDAC2HDAC8ESR2ESR1 | |
| SCHEMBL29360710 | 0.83 | ESR1 (0.47) | HDAC4HDAC2HDAC8ESR2ESR1 | |
| SCHEMBL2775233 | 0.83 | ESR1 (0.47) | HDAC4HDAC2HDAC8ESR2ESR1 | |
| SCHEMBL23598622 | 0.82 | HDAC4 (0.35) | HDAC4HDAC2HDAC8ESR2ESR1 | |
| SCHEMBL27267650 | 0.80 | ALDH1A1 (0.45) | HDAC8ALOX5ACMSDMCL1CA12 | |
| SCHEMBL24696780 | 0.80 | MCL1 (0.49) | HDAC4HDAC2HDAC8ACMSDMCL1 | |
| SCHEMBL25035794 | 0.79 | ESR1 (0.39) | HDAC4HDAC2HDAC8ESR2ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3998322-A1 | ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION, POWDER, ELECTRONIC EQUIPMENT, AND NOVEL COMPOUND | Idemitsu Kosan Co., Ltd. (JP) | 2022-05-18 | — | — | EP | disclosed |