Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 10/20 | 0.46 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 10/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | FLT1 | P17948 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | TEK | Q02763 | 1/20 | 0.43 |
| ▸ | DHFR | P00374 | 1/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2933188 | 1.00 | CHUK (0.48) | CHUKADORA2ANUDT1ADORA1KDM4E | |
| SCHEMBL23581559 | 0.81 | ADORA3 (0.57) | ADORA2AADORA1KDM4ECYP3A4MAPT | |
| SCHEMBL13765758 | 0.80 | KDM4E (0.50) | ADORA2AADORA1KDM4ECYP3A4MAPT | |
| SCHEMBL5997037 | 0.80 | KDM4E (0.44) | ADORA2AADORA1KDM4ECYP3A4MAPT | |
| SCHEMBL5848855 | 0.80 | KDM4E (0.44) | ADORA2AADORA1KDM4ECYP3A4MAPT | |
| SCHEMBL17815612 | 0.79 | CHUK (0.54) | CHUKKDRMAPK1CDK1 | |
| SCHEMBL30162764 | 0.78 | CHUK (0.50) | CHUKMAPTKDRCDK1 | |
| SCHEMBL5355400 | 0.78 | CHUK (0.50) | CHUKMAPTKDRCDK1 | |
| SCHEMBL2938674 | 0.77 | JAK2 (0.54) | ADORA2AADORA1KDM4ECYP3A4MAPT | |
| SCHEMBL14850580 | 0.77 | CDK1 (0.43) | CHUKADORA2ANUDT1KDM4ECYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108371662-B | Application of five-membered heterocyclic pyrimidine compound | 中国药科大学 | 2023-03-03 | — | — | CN | disclosed |