Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 3/20 | 0.49 |
| ▸ | ROS1 | P08922 | 4/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.45 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.44 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.44 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL30085607 | 1.00 | PIM1 (0.49) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL28894607 | 1.00 | PIM1 (0.49) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL28894809 | 1.00 | PIM1 (0.49) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL30085512 | 1.00 | PIM1 (0.49) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL28894602 | 1.00 | PIM1 (0.49) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL30085501 | 0.94 | CYP3A4 (0.48) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL30085813 | 0.94 | CYP3A4 (0.48) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL30085413 | 0.94 | CYP3A4 (0.48) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL28894738 | 0.94 | CYP3A4 (0.48) | PIM1ROS1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL28894740 | 0.94 | CYP3A4 (0.48) | PIM1ROS1PIK3CAPIK3CBPIK3CG |
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-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | claimed |
| CN-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | disclosed |