Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 2/20 | 0.47 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.47 |
| ▸ | CDK4 | P11802 | 1/20 | 0.47 |
| ▸ | CCND1 | P24385 | 1/20 | 0.47 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PRKCA | P17252 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.46 |
| ▸ | CDK9 | P50750 | 2/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3362091 | 0.84 | KDM4E (0.63) | KDM4EPOLBCTDSP1CDK2CCNE2 | |
| SCHEMBL22509195 | 0.83 | GSK3B (0.44) | KDM4EPOLBCDK2CDK4CCND1 | |
| SCHEMBL30705248 | 0.83 | GSK3B (0.44) | KDM4EPOLBCDK2CDK4CCND1 | |
| SCHEMBL24240371 | 0.82 | GSK3B (0.34) | KDM4ECDK2GSK3BABCB1ABCG2 | |
| SCHEMBL22509160 | 0.82 | GSK3B (0.46) | KDM4EPOLBCDK2ALDH1A1PRKCA | |
| SCHEMBL30705246 | 0.82 | GSK3B (0.46) | KDM4EPOLBCDK2ALDH1A1PRKCA | |
| SCHEMBL29212194 | 0.79 | BRD4 (0.48) | KDM4ECDK2CCNE2CDK4CCND1 | |
| SCHEMBL5096322 | 0.79 | MKNK1 (0.50) | KDM4ECDK2ALDH1A1CCNT1CDK9 | |
| SCHEMBL29419125 | 0.79 | MKNK1 (0.50) | KDM4ECDK2ALDH1A1CCNT1CDK9 | |
| SCHEMBL22509188 | 0.79 | GSK3B (0.49) | KDM4EALDH1A1PRKCAGSK3BCDK9 |
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-110357863-B | Triazine double aromatic ring derivative epidermal growth factor inhibitor and preparation method and application thereof | 药雅科技(上海)有限公司 | 2023-04-14 | — | — | CN | disclosed |