Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28851924 | 0.78 | ERN1 (0.36) | POLBL3MBTL1MAPTNPSR1APP | |
| SCHEMBL28805089 | 0.77 | POLB (0.39) | POLBL3MBTL1MAPTNPSR1APP | |
| SCHEMBL28179999 | 0.77 | ERN1 (0.35) | POLBL3MBTL1MAPTNPSR1APP | |
| SCHEMBL3594844 | 0.75 | ERN1 (0.42) | L3MBTL1MAPTAPPGAAALDH1A1 | |
| SCHEMBL3173111 | 0.75 | — | — | |
| SCHEMBL7458455 | 0.71 | — | — | |
| SCHEMBL1000103 | 0.70 | MAPT (0.58) | POLBL3MBTL1MAPTNPSR1APP | |
| SCHEMBL27429619 | 0.70 | — | — | |
| SCHEMBL2498762 | 0.65 | MAPT (0.52) | POLBL3MBTL1MAPTNPSR1APP | |
| SCHEMBL31211203 | 0.65 | MAPT (0.57) | POLBL3MBTL1MAPTNPSR1APP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108239074-B | Quinazoline compound, preparation method, application and pharmaceutical composition thereof | 中国医学科学院药物研究所 | 2021-07-06 | — | — | CN | disclosed |
| CN-108239076-B | Quinazoline compound, preparation method, application and pharmaceutical composition thereof | 中国医学科学院药物研究所 | 2021-07-06 | — | — | CN | disclosed |
| CN-108239075-B | Quinazoline compound, preparation method, application and pharmaceutical composition thereof | 中国医学科学院药物研究所 | 2021-07-02 | — | — | CN | disclosed |