Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 4/20 | 0.44 |
| ▸ | ADH1A | P07327 | 4/20 | 0.44 |
| ▸ | ADH1C | P00326 | 3/20 | 0.44 |
| ▸ | ADH7 | P40394 | 3/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | ADH4 | P08319 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9884573 | 0.84 | ADH1B (0.55) | ADH1BADH1AADH1CADH7EPHX1 | |
| SCHEMBL271572 | 0.84 | — | — | |
| SCHEMBL24920704 | 0.77 | KDM4E (0.41) | CYP3A4ALDH1A1TSHRKDM4E | |
| SCHEMBL19142335 | 0.76 | — | — | |
| SCHEMBL8693116 | 0.76 | TSHR (0.46) | ADH1BADH1AADH1CADH7EPHX1 | |
| SCHEMBL24920415 | 0.75 | — | — | |
| SCHEMBL28799214 | 0.73 | — | — | |
| SCHEMBL87734 | 0.72 | — | — | |
| SCHEMBL10536474 | 0.72 | — | — | |
| SCHEMBL79568 | 0.72 | TSHR (0.65) | ADH1BADH1AADH1CADH7EPHX1 |
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 |