Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.67 |
| ▸ | GAA | P10253 | 4/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.65 |
| ▸ | ACHE | P22303 | 1/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | NCF1 | P14598 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.51 |
| ▸ | HTR3A | P46098 | 2/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14691792 | 0.83 | EGFR (0.52) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL19989300 | 0.82 | ALDH1A1 (0.50) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL6534398 | 0.82 | EGFR (0.66) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL5354445 | 0.80 | HTR3A (0.75) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL26723750 | 0.80 | KDM4E (1.00) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL8249581 | 0.80 | KDM4E (0.67) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL6534257 | 0.79 | GRIN2D (0.60) | SMN1; SMN2 | |
| SCHEMBL14975993 | 0.79 | KDM4E (1.00) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL28803647 | 0.79 | HTR3A (0.73) | KDM4EGAAL3MBTL1ACHEHPGD | |
| SCHEMBL29351521 | 0.79 | KDM4E (1.00) | KDM4EGAAL3MBTL1ACHEHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111253326-B | 2-substituted-4-functionalized N (O, S) -quinazol derivative and application thereof | 河北美信医药科技有限公司 | 2020-12-08 | — | — | CN | disclosed |
| CN-111253326-A | 2-substituted-4-functionalized N (O, S) -quinazol derivative and application thereof | 河北美信医药科技有限公司 | 2020-06-09 | — | — | CN | disclosed |