Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | LIPE | Q05469 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29317766 | 0.85 | CHRM2 (0.38) | DPP4HRH3CYP2D6KCNH2MEN1 | |
| SCHEMBL29317762 | 0.77 | SMN1; SMN2 (0.47) | ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL29317761 | 0.77 | CA2 (0.38) | SMN1; SMN2 | |
| SCHEMBL5514914 | 0.77 | HRH3 (0.40) | DPP4HRH3HSP90AA1HSP90AB1LIPE | |
| SCHEMBL29317760 | 0.76 | LIPE (0.37) | LIPEMEN1ALDH1A1KMT2ATDP1 | |
| SCHEMBL9963903 | 0.75 | HSP90AA1 (0.41) | DPP4HSP90AA1HSP90AB1KCNH2MEN1 | |
| SCHEMBL23776804 | 0.72 | HRH3 (0.37) | DPP4HRH3CYP2D6KCNH2MEN1 | |
| SCHEMBL21843752 | 0.72 | CNR1 (0.38) | DPP4HRH3HSP90AA1HSP90AB1LIPE | |
| SCHEMBL12452605 | 0.72 | HSP90AA1 (0.40) | DPP4HSP90AA1HSP90AB1LIPE | |
| SCHEMBL2745757 | 0.72 | DPP4 (0.43) | DPP4HSP90AA1HSP90AB1LIPEDPP7 |
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-2024145931-A1 | SMALL MOLECULE INHIBITOR FOR β-CATENIN/BCL9 PROTEIN-PROTEIN INTERACTION AND USE THEREOF | 上海医药工业研究院有限公司 | 2024-07-11 | — | — | WO | disclosed |