Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9140040 | 0.98 | CCNA2 (0.33) | CCNA2CDK2CCNA1GSK3AGSK3B | |
| Hydrochloric Acid SCHEMBL9139780 | 0.84 | — | — | |
| SCHEMBL14324924 | 0.79 | CCNA2 (0.52) | CCNA2CDK2CCNA1GSK3AGSK3B | |
| SCHEMBL9140019 | 0.77 | GSK3A (0.34) | CCNA2CDK2CCNA1GSK3AGSK3B | |
| SCHEMBL4171832 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL9138606 | 0.74 | — | — | |
| Iodide SCHEMBL2379375 | 0.73 | — | — | |
| SCHEMBL3077441 | 0.72 | — | — | |
| SCHEMBL4421326 | 0.71 | LMNA (0.42) | ALDH1A1ADORA3ADORA2AADORA1 | |
| Hydrochloric Acid SCHEMBL28556945 | 0.71 | KLK1 (0.30) | — |
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-2004072078-A1 | PYRAZOLOTRIAZINE DERIVATIVES, METHODS FOR PRODUCTION AND USES THEREOF | UNIVERSITE LOUIS PASTEUR (FR) | 2004-08-26 | — | — | WO | disclosed |