Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | PFKFB3 | Q16875 | 2/20 | 0.53 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.48 |
| ▸ | CCND1 | P24385 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.48 |
| ▸ | CDK7 | P50613 | 1/20 | 0.48 |
| ▸ | CCNH | P51946 | 1/20 | 0.48 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.48 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.48 |
| ▸ | ACLY | P53396 | 1/20 | 0.45 |
| ▸ | WDR5 | P61964 | 2/20 | 0.45 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.45 |
| ▸ | TYMS | P04818 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | PFKFB4 | Q16877 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6205865 | 1.00 | TDP1 (0.57) | TDP1PFKFB3CDK1CCNB1CCNA2 | |
| SCHEMBL6205861 | 1.00 | TDP1 (0.57) | TDP1PFKFB3CDK1CCNB1CCNA2 | |
| SCHEMBL6205383 | 0.83 | ITGA1 (0.53) | PFKFB3CDK1CCNB1CCNA2CCND1 | |
| SCHEMBL6205381 | 0.83 | ITGA1 (0.53) | PFKFB3CDK1CCNB1CCNA2CCND1 | |
| SCHEMBL6205102 | 0.83 | ITGA1 (0.53) | PFKFB3CDK1CCNB1CCNA2CCND1 | |
| SCHEMBL6205307 | 0.82 | WDR5 (0.54) | WDR5ITGA1USP2NPC1PFKFB4 | |
| SCHEMBL6205309 | 0.82 | WDR5 (0.54) | WDR5ITGA1USP2NPC1PFKFB4 | |
| SCHEMBL6205304 | 0.82 | WDR5 (0.54) | WDR5ITGA1USP2NPC1PFKFB4 | |
| SCHEMBL6207012 | 0.81 | ITGA1 (0.69) | PFKFB3WDR5ITGA1USP2NPC1 | |
| SCHEMBL6204438 | 0.81 | ITGA1 (0.57) | WDR5ITGA1USP2NPC1MEN1 |
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-1100763-B1 | DIKETOACID-DERIVATIVES AS INHIBITORS OF POLYMERASES | ANGELETTI P IST RICHERCHE BIO (IT) | 2005-06-22 | — | — | EP | claimed |