Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.49 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.45 |
| ▸ | HTR3B | O95264 | 1/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.45 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17352154 | 0.83 | KDR (0.51) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| SCHEMBL17352152 | 0.83 | KDR (0.51) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| SCHEMBL375961 | 0.82 | TSHR (0.59) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| Hydrochloric Acid SCHEMBL6369011 | 0.81 | TSHR (0.57) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| SCHEMBL10656533 | 0.80 | KDR (0.56) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| SCHEMBL1794695 | 0.79 | KDR (0.54) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| SCHEMBL31542016 | 0.79 | KDR (0.54) | KDRNPFFR2HTR3EHTR3BHTR3A | |
| SCHEMBL7828899 | 0.78 | TSHR (0.63) | MAPT | |
| SCHEMBL28196307 | 0.78 | KIF11 (0.51) | NOTUM | |
| SCHEMBL1086197 | 0.77 | NPFFR2 (0.58) | KDRNPFFR2HTR3EHTR3BHTR3A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118976029-A | Pharmaceutical composition for preventing or treating parkinson's disease or nonalcoholic steatohepatitis | 韩国化学研究院 | 2024-11-19 | — | — | CN | disclosed |
| CN-114829344-B | Pyrimidine derivatives and pharmaceutical compositions containing the same | 韩国化学研究院 | 2024-08-13 | — | — | CN | disclosed |