Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.41 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2225385 | 0.95 | CDK1 (0.43) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2227241 | 0.84 | CDK1 (0.46) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2227638 | 0.84 | TNNI3K (0.57) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2226860 | 0.83 | TNNI3K (0.45) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2226143 | 0.81 | CCNA2 (0.47) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2226929 | 0.81 | ALDH1A1 (0.48) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2226099 | 0.81 | IRAK4 (0.44) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2224279 | 0.80 | EGFR (0.53) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2226407 | 0.80 | TNNI3K (0.42) | CDK2CDK1CCNB1CCNA2CCNE1 | |
| SCHEMBL2224234 | 0.80 | TNNI3K (0.43) | CDK2CDK1CCNB1CCNA2CCNE1 |
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-2523559-A1 | COMPOUNDS AND METHODS | GlaxoSmithKline LLC (US) | 2012-11-21 | — | — | EP | claimed |
| WO-2011088027-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2011-07-21 | — | — | WO | claimed |