Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCND3 | P30281 | 2/20 | 0.54 |
| ▸ | CCNK | O75909 | 1/20 | 0.54 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | CDK9 | P50750 | 1/20 | 0.54 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.54 |
| ▸ | JAK2 | O60674 | 4/20 | 0.48 |
| ▸ | JAK3 | P52333 | 3/20 | 0.48 |
| ▸ | EGFR | P00533 | 6/20 | 0.48 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21100262 | 0.87 | ALK (0.57) | CCND3CCNKCCNA2CDK2CDK9 | |
| SCHEMBL21099556 | 0.87 | IRAK4 (0.56) | CCND3CCNKCCNA2CDK2CDK9 | |
| SCHEMBL21100193 | 0.83 | IRAK4 (0.59) | JAK2EGFRIRAK4BRD4ALK | |
| SCHEMBL21099819 | 0.74 | IRAK4 (0.53) | JAK2JAK3EGFRIRAK4BRD4 | |
| SCHEMBL21099679 | 0.74 | CCND3 (0.51) | CCND3CCNKCCNA2CDK2CDK9 | |
| SCHEMBL19867185 | 0.74 | ALK (0.63) | CDK2JAK2JAK3EGFRIRAK4 | |
| SCHEMBL21099501 | 0.74 | ALK (0.52) | EGFRPTK2ALK | |
| SCHEMBL21099549 | 0.74 | IRAK4 (0.41) | CCND3CCNKCCNA2CDK2CDK9 | |
| SCHEMBL19867214 | 0.73 | PTK2 (0.59) | JAK2EGFRIRAK4BRD4ABCB11 | |
| SCHEMBL22807484 | 0.72 | SRC (0.70) | EGFRABCB11ESR1CHRM2HTR1A |
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-3498716-A1 | THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS | Hongyun Biotech Co., Ltd. (CN) | 2019-06-19 | — | — | EP | disclosed |