Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ESRRB | O95718 | 1/20 | 0.45 |
| ▸ | ESRRG | P62508 | 1/20 | 0.45 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22852275 | 1.00 | CYP2D6 (0.62) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL22852288 | 1.00 | CYP2D6 (0.62) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL22852294 | 0.96 | CYP2D6 (0.57) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL22852264 | 0.96 | CYP2D6 (0.57) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL22852296 | 0.96 | CYP2D6 (0.57) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL3515888 | 0.89 | SLC18A3 (0.60) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL14320844 | 0.85 | SLC18A3 (0.66) | CYP2D6CYP2C19SLC18A3CYP2C9SMN1; SMN2 | |
| SCHEMBL519944 | 0.84 | HRH3 (0.52) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL2874610 | 0.84 | HRH3 (0.52) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 | |
| SCHEMBL2876268 | 0.84 | HRH3 (0.52) | CYP2D6CYP2C19SLC18A3HRH3CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3992193-A1 | PYRAZOLOPYRIMIDINE COMPOUND, PREPARATION METHOD FOR SAME, AND APPLICATIONS THEREOF | Shanghai Pharmaceuticals Holding Co., Ltd. (CN) | 2022-05-04 | — | — | EP | disclosed |
| WO-2020259703-A1 | PYRAZOLOPYRIMIDINE COMPOUND, PREPARATION METHOD FOR SAME, AND APPLICATIONS THEREOF | 上海医药集团股份有限公司 | 2020-12-30 | — | — | WO | disclosed |