Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 4/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.46 |
| ▸ | CDK2 | P24941 | 3/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 3/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 3/20 | 0.39 |
| ▸ | CACNA1I | Q9P0X4 | 3/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | GLS | O94925 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5594175 | 0.87 | AURKA (0.58) | AURKAAURKBCDK2CDK1CDK4 | |
| SCHEMBL14539029 | 0.80 | AURKA (0.39) | AURKAAURKBGSK3BSMN1; SMN2 | |
| SCHEMBL5594098 | 0.77 | AURKA (0.68) | AURKAAURKBCDK2CDK1CDK4 | |
| SCHEMBL14538838 | 0.73 | AURKA (0.58) | AURKAAURKBCDK2CDK1CDK4 | |
| SCHEMBL4495289 | 0.70 | GSK3B (0.73) | AURKBCDK2CDK1CDK4GSK3B | |
| SCHEMBL5867743 | 0.63 | CDK2 (0.45) | CDK2CDK1CDK4CACNA1GCACNA1H | |
| SCHEMBL22890624 | 0.62 | LRRK2 (0.74) | — | |
| SCHEMBL22890323 | 0.62 | LRRK2 (0.74) | — | |
| SCHEMBL29643542 | 0.62 | LRRK2 (0.74) | — | |
| SCHEMBL6390395 | 0.61 | CDK2 (0.47) | CDK2CDK1CDK4CACNA1GCACNA1H |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007058626-A1 | INDAZOLE COMPOUNDS | S*BIO PTE LTD (SG) | 2007-05-24 | — | — | WO | claimed |