Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | ESRRG | P62508 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL24270269 | 0.85 | PPARG (0.35) | HPGDHSD17B10LMNAALDH1A1PPARG | |
| SCHEMBL27199273 | 0.82 | HTR1D (0.38) | HPGDHSD17B10ALDH1A1HDAC4HDAC2 | |
| SCHEMBL30803777 | 0.82 | HTR1D (0.38) | HPGDHSD17B10ALDH1A1HDAC4HDAC2 | |
| SCHEMBL24270320 | 0.82 | S1PR1 (0.32) | — | |
| SCHEMBL24270276 | 0.81 | PPARG (0.32) | PPARG | |
| SCHEMBL24270268 | 0.79 | KIF11 (0.47) | — | |
| SCHEMBL25847216 | 0.76 | ESR1 (0.40) | ESR1ESR2CYP3A4ALDH1A1PPARG | |
| SCHEMBL22588745 | 0.76 | HTR1D (0.37) | HDAC4HDAC2HDAC8DNMT1PGR | |
| SCHEMBL29625625 | 0.74 | KIF11 (0.38) | ALDH1A1HDAC4HDAC2HDAC8PPARG | |
| SCHEMBL21971596 | 0.73 | KIF11 (0.41) | HPGDHSD17B10TSHRALDH1A1HDAC4 |
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-2022074616-A1 | HETEROCYCLIC COMPOUND AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE HETEROCYCLIC COMPOUND | IDEMITSU KOSAN CO., LTD. (JP) | 2022-04-14 | — | — | WO | disclosed |