Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10788028 | 0.88 | NPC1 (0.52) | PTGS2CYP3A4HTTNPC1HPGD | |
| SCHEMBL10782672 | 0.88 | DHFR (0.40) | CNR1CNR2PTGS2CYP3A4ALOX5 | |
| SCHEMBL29079418 | 0.86 | PTGS2 (0.57) | PTGS2CYP3A4HTTNPC1HPGD | |
| SCHEMBL29079429 | 0.84 | PTGS2 (0.58) | PTGS2CYP3A4HTTNPC1HPGD | |
| SCHEMBL10782519 | 0.84 | PTGS2 (0.58) | PTGS2CYP3A4HTTNPC1HPGD | |
| SCHEMBL29079405 | 0.84 | PTGS2 (0.58) | PTGS2CYP3A4HTTNPC1HPGD | |
| SCHEMBL1023215 | 0.84 | DHFR (0.45) | CNR1CNR2PTGS2CYP3A4HTT | |
| SCHEMBL1023550 | 0.82 | DHFR (0.47) | CNR1CNR2PTGS2CYP3A4HTT | |
| SCHEMBL10788697 | 0.82 | HSPA5 (0.47) | PTGS2CYP3A4HPGDMAPK1ALOX5 | |
| SCHEMBL11330033 | 0.81 | PTGS2 (0.55) | PTGS2CYP3A4HTTALOX5ALDH1A1 |
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-116813900-A | Double-end hydroxyl low molecular weight polyphenyl ether and synthesis method thereof | 北京赛福瑞技术服务有限公司 | 2023-09-29 | — | — | CN | disclosed |