Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.45 |
| ▸ | CDK9 | P50750 | 2/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 3/20 | 0.42 |
| ▸ | KIT | P10721 | 2/20 | 0.42 |
| ▸ | FLT3 | P36888 | 2/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CCNH | P51946 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2597583 | 0.86 | CCNT1 (0.44) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597598 | 0.84 | HDAC3 (0.53) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597549 | 0.84 | CCNT1 (0.43) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL31054180 | 0.83 | CCNT1 (0.52) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597569 | 0.83 | CCNT1 (0.52) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597604 | 0.83 | CCNT1 (0.47) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597767 | 0.77 | CCNT1 (0.42) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2598615 | 0.76 | JAK2 (0.45) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597585 | 0.76 | HDAC3 (0.48) | CCNT1CDK2CDK9CCNE1JAK2 | |
| SCHEMBL2597630 | 0.74 | JAK2 (0.51) | CCNT1CDK2CDK9CCNE1JAK2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2571856-A1 | COMPOUNDS | BTG International Limited (GB) | 2013-03-27 | — | — | EP | claimed |
| WO-2011144577-A1 | COMPOUNDS | SENEXIS LIMITED (GB) | 2011-11-24 | — | — | WO | claimed |
| EP-2571856-A1 | COMPOUNDS | BTG International Limited (GB) | 2013-03-27 | — | — | EP | disclosed |
| WO-2011144577-A1 | COMPOUNDS | SENEXIS LIMITED (GB) | 2011-11-24 | — | — | WO | disclosed |
| WO-2011144577-A1 | COMPOUNDS | SENEXIS LIMITED (GB) | 2011-11-24 | — | — | WO | disclosed |