Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.62 |
| ▸ | BRD4 | O60885 | 1/20 | 0.62 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.62 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | STAT3 | P40763 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.53 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.51 |
| ▸ | KDR | P35968 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28678352 | 0.82 | EGFR (0.51) | EGFRBRD4ERBB2ERBB4ABCG2 | |
| SCHEMBL29898247 | 0.82 | EGFR (0.51) | EGFRBRD4ERBB2ERBB4ABCG2 | |
| SCHEMBL28702190 | 0.82 | EGFR (0.55) | EGFRBRD4ERBB2ERBB4MAPK1 | |
| SCHEMBL28699733 | 0.81 | LDHA (0.56) | EGFRBRD4ERBB2ERBB4MAPK1 | |
| SCHEMBL28696736 | 0.78 | LDHA (0.52) | EGFRMAPK1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5864703 | 0.74 | EGFR (0.84) | EGFRABCG2KDRLCK | |
| SCHEMBL28673404 | 0.73 | HPGD (0.39) | MAPK1KMT2ASMN1; SMN2LMNAHPGD | |
| SCHEMBL8351408 | 0.73 | MAPK1 (0.67) | EGFRBRD4ERBB2ERBB4MAPK1 | |
| SCHEMBL28681169 | 0.72 | METAP1 (0.42) | MAPK1KMT2ASMN1; SMN2HTTLMNA | |
| SCHEMBL18292695 | 0.72 | MAPK1 (0.66) | EGFRBRD4ERBB2ERBB4MAPK1 |
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 |