Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | EEF2K | O00418 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | MARK3 | P27448 | 1/20 | 0.34 |
| ▸ | AXL | P30530 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.34 |
| ▸ | NEK2 | P51955 | 1/20 | 0.34 |
| ▸ | NEK4 | P51957 | 1/20 | 0.34 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9691679 | 0.86 | S1PR1 (0.38) | MYCPDK2CDC7EEF2KDAPK3 | |
| SCHEMBL20504277 | 0.77 | SMN1; SMN2 (0.43) | ALDH1A1KDM4EHPGDMEN1LMNA | |
| SCHEMBL15811768 | 0.77 | INPPL1 (0.49) | MYCALDH1A1KDM4EGAAHPGD | |
| SCHEMBL15811767 | 0.76 | MAPT (0.42) | MYCALDH1A1KDM4ETP53GAA | |
| SCHEMBL1882143 | 0.76 | CA2 (0.36) | PDK2ALDH1A1KDM4EGAAHSD17B10 | |
| Hydrochloric Acid SCHEMBL29234080 | 0.75 | SMN1; SMN2 (0.42) | ALDH1A1KDM4EHPGDMEN1LMNA | |
| SCHEMBL1887092 | 0.74 | MAPT (0.46) | ALDH1A1KDM4EGAAMEN1LMNA | |
| SCHEMBL1884447 | 0.73 | PDK2 (0.37) | MYCPDK2CDC7MARK3AXL | |
| SCHEMBL3355661 | 0.72 | MYC (0.47) | MYCPDK2HEXAHEXBALDH1A1 | |
| SCHEMBL9064517 | 0.72 | PSMB5 (0.38) | PDK2CDC7MARK3AXLNEK4 |
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-0510689-A1 | Hydrocyanation of pentenenitriles using cyanohydrins | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-10-28 | — | — | EP | disclosed |