Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.34 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.34 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.32 |
| ▸ | PRKACG | P22612 | 1/20 | 0.32 |
| ▸ | PRKACB | P22694 | 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 | |
|---|---|---|---|---|
| SCHEMBL21491118 | 1.00 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| SCHEMBL21491275 | 0.81 | ESR1 (0.38) | — | |
| SCHEMBL21491362 | 0.81 | CDC7 (0.33) | SLC6A2SLC6A4SLC6A3PRKACAPRKACG | |
| SCHEMBL31472367 | 0.81 | ESR1 (0.38) | — | |
| SCHEMBL31472302 | 0.81 | CDC7 (0.33) | SLC6A2SLC6A4SLC6A3PRKACAPRKACG | |
| SCHEMBL21491281 | 0.78 | CYP11B2 (0.39) | SLC6A2SLC6A4SLC6A3PRKACAPRKACG | |
| SCHEMBL31472438 | 0.78 | CYP11B2 (0.39) | SLC6A2SLC6A4SLC6A3PRKACAPRKACG | |
| SCHEMBL29456404 | 0.78 | CYP11B2 (0.39) | SLC6A2SLC6A4SLC6A3PRKACAPRKACG | |
| SCHEMBL24313477 | 0.78 | KAT2B (0.32) | KCNH2 | |
| SCHEMBL24313232 | 0.78 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3PRKAB2PRKAG1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112236428-B | Antiproliferative compounds and uses thereof | 默克专利股份有限公司 | 2025-04-01 | — | — | CN | disclosed |