Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 10/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | KDR | P35968 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.45 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RET | P07949 | 2/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL5828729 | 1.00 | EGFR (0.50) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL5828851 | 0.95 | KDM1A (0.49) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL5828850 | 0.95 | KDM1A (0.49) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL5828872 | 0.93 | HTT (0.48) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL5828868 | 0.93 | HTT (0.48) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL5827881 | 0.88 | RET (0.47) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL5827885 | 0.88 | RET (0.47) | EGFRMAPK1HTTKDRHPGD | |
| SCHEMBL6981093 | 0.87 | EGFR (0.47) | EGFRHTTKDRHPGDALDH1A1 | |
| SCHEMBL6984999 | 0.84 | EPHA2 (0.59) | KDR | |
| SCHEMBL6983822 | 0.83 | EPHA2 (0.42) | EGFRKDRLCKALDH1A1RET |
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 |
|---|---|---|---|---|---|---|---|
| US-7001904-B1 | Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases | ASTRAZENECA AB (SE) | 2006-02-21 | — | — | US | disclosed |