Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 3/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | GSK3A | P49840 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7086914 | 1.00 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C9MEN1USP2 | |
| SCHEMBL1262019 | 0.75 | MKNK2 (0.53) | MAPK1AURKBKDM4EBRAFEGFR | |
| SCHEMBL1262018 | 0.75 | MKNK2 (0.53) | MAPK1AURKBKDM4EBRAFEGFR | |
| SCHEMBL7086918 | 0.74 | SYK (0.46) | CYP1A2CYP3A4CYP2C9MEN1USP2 | |
| SCHEMBL30209645 | 0.71 | KDM4E (0.56) | CYP1A2CYP2C9MEN1CYP2C19KMT2A | |
| SCHEMBL4716351 | 0.70 | GSK3B (0.47) | MEN1TSHRMAPK1KMT2ASYK | |
| SCHEMBL4716354 | 0.70 | GSK3B (0.47) | MEN1TSHRMAPK1KMT2ASYK | |
| SCHEMBL12120895 | 0.70 | JAK2 (0.51) | CYP1A2CYP3A4CYP2C9MEN1USP2 | |
| SCHEMBL7060640 | 0.70 | ABCG2 (0.54) | MAPK1AURKBEGFRMAP4K4PIM1 | |
| SCHEMBL5717630 | 0.70 | LMNA (0.73) | CYP1A2MEN1MAPK1CYP2C19KMT2A |
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-1366027-A1 | COMBI-MOLECULES HAVING SIGNAL TRANSDUCTION INHIBITORY PROPERTIES AND DNA DAMAGING PROPERTIES | McGILL UNIVERSITY (CA) | 2003-12-03 | — | — | EP | disclosed |
| WO-2002068396-A1 | COMBI-MOLECULES HAVING SIGNAL TRANSDUCTION INHIBITORY PROPERTIES AND DNA DAMAGING PROPERTIES | MCGILL UNIVERSITY (CA) | 2002-09-06 | — | — | WO | disclosed |