Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | ATM | Q13315 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.58 |
| ▸ | PRKCA | P17252 | 4/20 | 0.56 |
| ▸ | CDK4 | P11802 | 3/20 | 0.56 |
| ▸ | CCND1 | P24385 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.56 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.56 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.56 |
| ▸ | PRKCG | P05129 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL21563828 | 0.78 | KDM4E (0.67) | ALDH1A1KDM4ELMNAGLAGAA | |
| SCHEMBL5621445 | 0.78 | ALDH1A1 (0.73) | ALDH1A1KDM4ELMNAGLAGAA | |
| SCHEMBL4703362 | 0.78 | CHEK1 (0.67) | ALDH1A1KDM4ELMNAGLAGAA | |
| Acridone SCHEMBL29360611 | 0.77 | ALDH1A1 (1.00) | ALDH1A1KDM4ELMNAGLAGAA | |
| SCHEMBL30350396 | 0.77 | ALDH1A1 (0.90) | ALDH1A1KDM4ELMNAGLAGAA | |
| Acridone SCHEMBL19289 | 0.77 | ALDH1A1 (1.00) | ALDH1A1KDM4ELMNAGLAGAA | |
| SCHEMBL4146783 | 0.77 | ALDH1A1 (0.90) | ALDH1A1KDM4ELMNAGLAGAA | |
| Acridone SCHEMBL29641306 | 0.77 | ALDH1A1 (1.00) | ALDH1A1KDM4ELMNAGLAGAA | |
| Acridone SCHEMBL11519726 | 0.77 | ALDH1A1 (1.00) | ALDH1A1KDM4ELMNAGLAGAA | |
| SCHEMBL30741432 | 0.77 | CHEK1 (0.65) | ALDH1A1KDM4ELMNAGLAGAA |
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-2011034051-A1 | NOVEL CYCLIC SQUARAMIDE DERIVATIVES | 参天製薬株式会社 (JP) | 2011-03-24 | — | — | WO | disclosed |