Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | ELANE | P08246 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29133923 | 0.72 | TSHR (0.46) | HTTALDH1A1KDM4ELMNATSHR | |
| SCHEMBL24782682 | 0.72 | SIRT3 (0.42) | CYP2C19PDE3ACHRNB2CHRNA4 | |
| SCHEMBL25637974 | 0.71 | GAA (0.43) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL20043 | 0.71 | HTT (0.50) | KMT2AHTTMEN1NCOA3ALDH1A1 | |
| SCHEMBL29546988 | 0.71 | HTT (0.50) | KMT2AHTTMEN1NCOA3ALDH1A1 | |
| SCHEMBL526349 | 0.70 | — | — | |
| SCHEMBL342957 | 0.70 | — | — | |
| SCHEMBL31247415 | 0.70 | — | — | |
| SCHEMBL30706761 | 0.70 | — | — | |
| SCHEMBL2645295 | 0.70 | — | — |
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-114315900-B | 3-aryl pyrazolopyrimidine derivative and application thereof | 美迪西普胜医药科技(上海)有限公司 | 2023-09-05 | — | — | CN | claimed |
| CN-114315900-B | 3-aryl pyrazolopyrimidine derivative and application thereof | 美迪西普胜医药科技(上海)有限公司 | 2023-09-05 | — | — | CN | disclosed |