Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | KLRK1 | P26718 | 3/20 | 0.42 |
| ▸ | MICA | Q29983 | 3/20 | 0.42 |
| ▸ | RAET1L | Q5VY80 | 3/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2745460 | 0.86 | CYP2C8 (0.49) | KIF11ALDH1A1SMN1; SMN2BACE1KLRK1 | |
| SCHEMBL2564888 | 0.84 | BCAT2 (0.65) | PARP1BCAT2CASP1KIF11KDM4E | |
| SCHEMBL17803632 | 0.83 | SLC6A4 (0.51) | JAK2BCAT2DHODH | |
| SCHEMBL27906241 | 0.83 | BCAT2 (0.62) | PARP1BCAT2CASP1DHODHKIF11 | |
| SCHEMBL28262741 | 0.82 | PARP1 (0.48) | PARP1JAK2BCAT2CASP1DHODH | |
| SCHEMBL29917415 | 0.82 | SLC6A3 (0.52) | KDM4EBACE1KLRK1MICARAET1L | |
| Trifluoroacetic Acid SCHEMBL1785126 | 0.82 | BCAT2 (0.57) | PARP1BCAT2SMN1; SMN2PDK2 | |
| SCHEMBL14813212 | 0.81 | CHEK1 (0.49) | BCAT2SCN9A | |
| SCHEMBL29941849 | 0.81 | MKNK1 (0.55) | PARP1BCAT2 | |
| SCHEMBL30034930 | 0.80 | BCAT2 (0.69) | PARP1BCAT2KDM4EALDH1A1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2501370-A1 | METHODS AND COMPOSITIONS FOR TREATING SOLID TUMORS AND OTHER MALIGNANCIES | Novartis AG (CH) | 2012-09-26 | — | — | EP | disclosed |
| WO-2011062939-A1 | METHODS AND COMPOSITIONS FOR TREATING SOLID TUMORS AND OTHER MALIGNANCIES | NOVARTIS AG (CH) | 2011-05-26 | — | — | WO | disclosed |