Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 7/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30137742 | 1.00 | KCNH2 (0.44) | KCNH2ESR2NOTUMSMN1; SMN2MEN1 | |
| SCHEMBL28967487 | 0.86 | NPC1 (0.46) | KCNH2ESR2SMN1; SMN2MEN1NPC1 | |
| SCHEMBL7848179 | 0.82 | ESR2 (0.55) | ESR2SMN1; SMN2MEN1NPC1LMNA | |
| SCHEMBL1712561 | 0.81 | ADORA3 (0.54) | ESR2NOTUMSMN1; SMN2MEN1NPC1 | |
| SCHEMBL19961707 | 0.81 | NOTUM (0.47) | ESR2NOTUMSMN1; SMN2MEN1NPC1 | |
| SCHEMBL29472998 | 0.80 | PARP1 (0.56) | ESR2NOTUMSMN1; SMN2MEN1NPC1 | |
| SCHEMBL28550590 | 0.80 | PARP1 (0.56) | ESR2NOTUMSMN1; SMN2MEN1NPC1 | |
| Water SCHEMBL4710592 | 0.79 | ADORA3 (0.52) | ESR2NOTUMSMN1; SMN2MEN1NPC1 | |
| SCHEMBL29479675 | 0.78 | ESR2 (0.42) | ESR2SMN1; SMN2MEN1NPC1LMNA | |
| SCHEMBL29028688 | 0.77 | NPC1 (0.46) | ESR2NOTUMSMN1; SMN2MEN1NPC1 |
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-115613060-A | Method for synthesizing C-3 phosphorylated 2H-indazole compound by direct electrochemical oxidation | 浙江工业大学 | 2023-01-17 | — | — | CN | disclosed |