Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GBA1 | P04062 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCND3 | P30281 | 1/20 | 0.33 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL1570155 | 0.80 | HSD11B1 (0.44) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL12607 | 0.80 | ALDH1A1 (0.53) | ALDH1A1SIGMAR1KDM4EKMT2ATDP1 | |
| SCHEMBL18776398 | 0.80 | KDM1A (0.42) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL26031963 | 0.80 | KDM1A (0.42) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL259415 | 0.78 | GBA1 (0.44) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL633682 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL14488177 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL4761260 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL18664097 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL19983442 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2215085-B1 | PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2011-09-07 | — | — | EP | disclosed |