Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | PDE4A | P27815 | 2/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.46 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 7/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3605697 | 0.87 | PDE4D (0.55) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL12096338 | 0.81 | SMN1; SMN2 (0.54) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3103824 | 0.78 | NOTUM (0.43) | CYP1A2CYP2C9MAPK1CYP2C19NPC1 | |
| SCHEMBL30745584 | 0.78 | NOTUM (0.43) | CYP1A2CYP2C9MAPK1CYP2C19NPC1 | |
| SCHEMBL14911053 | 0.78 | PDE4A (0.46) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31662983 | 0.77 | PDE4A (0.45) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17003768 | 0.76 | PDE4D (0.50) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL30244557 | 0.76 | GRIN2B (0.40) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6774958 | 0.76 | SCN4A (0.43) | ALDH1A1MAPT | |
| SCHEMBL27394120 | 0.73 | ALDH1A1 (0.41) | SMN1; SMN2PDE3BPDE3ALMNATP53 |
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-105431437-A | PI3K protein kinase inhibitors, in particular inhibitors and/or gamma inhibitors | RHIZEN PHARMACEUTICALS SA | 2016-03-23 | — | — | CN | disclosed |