Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC40A1 | Q9NP59 | 2/20 | 0.47 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MET | P08581 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.44 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | PDE4A | P27815 | 4/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.43 |
| ▸ | TOP1 | P11387 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8126772 | 0.86 | CYP2C19 (0.57) | SLC40A1GLO1CYP2C19MAPTTDP1 | |
| SCHEMBL30405579 | 0.80 | CYP2C19 (0.51) | HTR6CYP2C19MAPTCCNE1CDK2 | |
| SCHEMBL5716751 | 0.80 | PDE4A (0.46) | SLC40A1CYP2C19MAPTCCNE1CDK2 | |
| SCHEMBL5716793 | 0.79 | HDAC3 (0.55) | SLC40A1GLO1CYP2C19MAPTTDP1 | |
| SCHEMBL31160496 | 0.76 | L3MBTL1 (0.46) | SLC40A1CYP2C19MAPTCCNE1CDK2 | |
| SCHEMBL30337641 | 0.75 | CYP2C19 (0.56) | SLC40A1GLO1HTR6CYP2C19MAPT | |
| SCHEMBL1772416 | 0.75 | CYP2C19 (0.56) | SLC40A1GLO1HTR6CYP2C19MAPT | |
| SCHEMBL1962059 | 0.74 | HDAC3 (0.43) | SLC40A1GLO1HTR6CYP2C19MAPT | |
| SCHEMBL1962060 | 0.74 | HDAC3 (0.43) | SLC40A1GLO1HTR6CYP2C19MAPT | |
| SCHEMBL5716795 | 0.74 | CYP2C19 (0.42) | SLC40A1CYP2C19MAPTCCNE1CDK2 |
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-105246890-A | Pyrrolo[2, 3-b]pyridine cdk9 kinase inhibitors | ABBVIE INC | 2016-01-13 | — | — | CN | disclosed |