Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCK | P08631 | 5/20 | 0.42 |
| ▸ | BTK | Q06187 | 3/20 | 0.42 |
| ▸ | KDR | P35968 | 3/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | INSR | P06213 | 2/20 | 0.34 |
| ▸ | LCK | P06239 | 2/20 | 0.34 |
| ▸ | LYN | P07948 | 2/20 | 0.34 |
| ▸ | SRC | P12931 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL21337921 | 0.85 | HCK (0.43) | HCKBTKKDRDPP4INSR | |
| SCHEMBL1832785 | 0.84 | HCK (0.42) | HCKBTKKDRDPP4INSR | |
| SCHEMBL1832782 | 0.80 | HCK (0.44) | HCKBTKKDRINSRLCK | |
| SCHEMBL1827382 | 0.78 | HCK (0.47) | HCKBTKKDRDPP4HRH4 | |
| SCHEMBL21337843 | 0.77 | HCK (0.47) | HCKBTKKDRDPP4HRH4 | |
| SCHEMBL3232951 | 0.76 | LCK (0.56) | HCKBTKKDRINSRLCK | |
| SCHEMBL1829414 | 0.76 | LCK (0.49) | HCKBTKKDRINSRLCK | |
| SCHEMBL1823112 | 0.74 | HCK (0.49) | HCKBTKKDRINSRLCK | |
| SCHEMBL1825447 | 0.74 | HCK (0.46) | HCKBTKKDRINSRLCK | |
| SCHEMBL1823572 | 0.74 | HCK (0.46) | HCKBTKKDRINSRLCK |
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-1758892-B1 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2012-10-17 | — | — | EP | claimed |