Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.32 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24920813 | 0.81 | PDK2 (0.37) | PDK2CYP1A2CYP3A4MEN1ALDH1A1 | |
| SCHEMBL24920808 | 0.78 | ALDH1A1 (0.38) | PDK2CYP1A2TGFBR1TGFBR2CYP3A4 | |
| SCHEMBL24920900 | 0.76 | PDK2 (0.35) | PDK2CYP1A2CYP3A4MEN1ALDH1A1 | |
| SCHEMBL21905028 | 0.71 | CYP1A2 (0.37) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL26258152 | 0.71 | PDK2 (0.39) | PDK2HCRTR2CYP1A2CYP3A4MEN1 | |
| SCHEMBL24921600 | 0.70 | TAAR1 (0.34) | HCRTR2TGFBR2NPC1RAB9AGRIN1 | |
| SCHEMBL24920789 | 0.70 | HCRTR2 (0.37) | HCRTR2ALDH1A1 | |
| SCHEMBL2511301 | 0.70 | QPCT (0.39) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL14972263 | 0.70 | CYP1A2 (0.45) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL24921590 | 0.70 | TUBB4A (0.34) | CYP1A2ALDH1A1TSHR |
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-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |