Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.46 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.46 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 9/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 8/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | JAK3 | P52333 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28081509 | 0.87 | BCAT2 (0.61) | CTNNB1BCAT2ALDH1A1PARP1KDM4E | |
| SCHEMBL4789960 | 0.81 | CTNNB1 (0.56) | CTNNB1PKN1PKN2MKNK1MKNK2 | |
| SCHEMBL167082 | 0.80 | BCAT2 (0.67) | BCAT2PKN1PKN2MKNK1MKNK2 | |
| SCHEMBL31227976 | 0.80 | BCAT2 (0.67) | BCAT2PKN1PKN2MKNK1MKNK2 | |
| SCHEMBL30514275 | 0.80 | BCAT2 (0.67) | BCAT2PKN1PKN2MKNK1MKNK2 | |
| SCHEMBL28131715 | 0.79 | ALDH1A1 (0.47) | CTNNB1MKNK1MKNK2ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL27890957 | 0.78 | BCAT2 (0.65) | BCAT2PKN1PKN2MKNK1MKNK2 | |
| Hydrochloric Acid SCHEMBL30165666 | 0.78 | BCAT2 (0.65) | BCAT2PKN1PKN2MKNK1MKNK2 | |
| SCHEMBL3717538 | 0.78 | CA12 (0.43) | ALDH1A1HSD17B10KDM4ELMNA | |
| SCHEMBL8809860 | 0.78 | BCAT2 (0.56) | BCAT2PKN1PKN2MKNK1MKNK2 |
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-1957073-A2 | MEDICINAL DRUG | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007066784-A2 | DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-06-14 | — | — | WO | disclosed |