Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 5/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18294577 | 0.76 | MPO (0.61) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL1092954 | 0.76 | MPO (0.56) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL14116547 | 0.76 | MPO (0.56) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL28792817 | 0.76 | ESR2 (0.74) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL13080474 | 0.76 | MPO (0.56) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL1921321 | 0.74 | MPO (0.50) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL31268518 | 0.73 | MPO (0.49) | MPOESR2ALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL1921361 | 0.72 | MPO (0.47) | MPOESR2KDM4EALDH1A1NPC1 | |
| SCHEMBL1921618 | 0.72 | MPO (0.51) | MPOESR2KDM4EHPGDALDH1A1 | |
| SCHEMBL29028700 | 0.72 | MPO (0.47) | MPOESR2KDM4EHPGDALDH1A1 |
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-113862705-A | Electrochemical synthesis method of 2-aryl-3-halo-2H-indazole compound | 浙江工业大学 | 2021-12-31 | — | — | CN | disclosed |