Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 5/20 | 0.68 |
| ▸ | CCND3 | P30281 | 2/20 | 0.68 |
| ▸ | CCNK | O75909 | 1/20 | 0.68 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.68 |
| ▸ | CDK9 | P50750 | 1/20 | 0.68 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.68 |
| ▸ | CDK4 | P11802 | 5/20 | 0.58 |
| ▸ | CCND1 | P24385 | 5/20 | 0.58 |
| ▸ | CCND2 | P30279 | 1/20 | 0.58 |
| ▸ | JAK2 | O60674 | 4/20 | 0.56 |
| ▸ | JAK3 | P52333 | 2/20 | 0.56 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | SYK | P43405 | 2/20 | 0.53 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.51 |
| ▸ | EGFR | P00533 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29847699 | 0.87 | JAK2 (0.62) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL16514118 | 0.87 | JAK2 (0.62) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL16513933 | 0.86 | CDK2 (0.58) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL16513502 | 0.86 | CCND3 (0.65) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL16513586 | 0.84 | EGFR (0.59) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL29847649 | 0.84 | EGFR (0.59) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL16513819 | 0.84 | EGFR (0.59) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL29848021 | 0.84 | EGFR (0.59) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL16513575 | 0.83 | CCND3 (0.57) | CDK2CCND3CCNKCCNA2CDK9 | |
| SCHEMBL28459543 | 0.81 | CCNA2 (1.00) | CDK2CCND3CCNKCCNA2CDK9 |
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-3508204-A1 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | Neupharma, Inc. (US) | 2019-07-10 | — | — | EP | disclosed |