Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.55 |
| ▸ | BRD4 | O60885 | 1/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.55 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.49 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | STAT3 | P40763 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | RAF1 | P04049 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | NOD1 | Q9Y239 | 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 | |
|---|---|---|---|---|
| SCHEMBL28693632 | 0.82 | LDHA (0.52) | EGFRBRD4ERBB2ERBB4MAPK1 | |
| SCHEMBL28682743 | 0.82 | PDE1B (0.47) | EGFRERBB2MAPK1KDM4EALDH1A1 | |
| SCHEMBL29898304 | 0.82 | PDE1B (0.47) | EGFRERBB2MAPK1KDM4EALDH1A1 | |
| SCHEMBL28693417 | 0.82 | EGFR (0.62) | EGFRBRD4ERBB2ERBB4MAPK1 | |
| SCHEMBL28698734 | 0.81 | EGFR (0.64) | EGFRBRD4ERBB2ERBB4MAPK1 | |
| SCHEMBL28691845 | 0.80 | LDHA (0.48) | EGFRMAPK1KDM4EALDH1A1ABCG2 | |
| SCHEMBL28672040 | 0.79 | SCN9A (0.44) | KDM4EALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL28673410 | 0.78 | MEN1 (0.42) | ALDH1A1MEN1KMT2ASMN1; SMN2HTT | |
| SCHEMBL28681165 | 0.77 | POLB (0.42) | KDM4EALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL28687181 | 0.77 | SCN9A (0.46) | MAPK1KDM4EALDH1A1MEN1KMT2A |
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-113754636-A | Quinazoline-containing aza-ether compounds | 湖南化工研究院有限公司 | 2021-12-07 | — | — | CN | claimed |