Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
| ▸ | RRM2 | P31350 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16887859 | 0.74 | ALDH1A1 (0.36) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| SCHEMBL10052277 | 0.72 | MEN1 (0.34) | ALDH1A1HPGDALOX12MEN1MAPT | |
| SCHEMBL16887861 | 0.70 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| SCHEMBL9134809 | 0.70 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| SCHEMBL28647073 | 0.67 | TDP1 (0.48) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| SCHEMBL7606757 | 0.66 | ERBB2 (0.41) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| SCHEMBL27594442 | 0.66 | TDP1 (0.40) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| Benzoquinone SCHEMBL26923622 | 0.66 | TDP1 (0.57) | ALDH1A1TP53TSHRHSD17B10HPGD | |
| SCHEMBL15630516 | 0.65 | ALDH1A1 (0.36) | ALDH1A1HSD17B10HPGDALOX12MEN1 | |
| SCHEMBL10567292 | 0.65 | ALDH1A1 (0.36) | ALDH1A1HSD17B10HPGDALOX12MEN1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114634515-A | Stereoselective synthesis method of (3aS,6aR) -lactone | 复旦大学 | 2022-06-17 | — | — | CN | disclosed |
| CN-114560865-A | Continuous flow synthesis method of (3aS,6aR) -lactone | 复旦大学 | 2022-05-31 | — | — | CN | disclosed |
| CN-104987350-B | One kind has chiral alpha aminophosphonate compound and preparation and the application of the heterocycle containing benzothiazole of antiviral activity | 贵州大学 | 2017-12-05 | — | — | CN | disclosed |
| CN-104987350-B | One kind has chiral alpha aminophosphonate compound and preparation and the application of the heterocycle containing benzothiazole of antiviral activity | 贵州大学 | 2017-12-05 | — | — | CN | disclosed |
| CN-106866977-A | Rapid and efficient conjugation process | 香港中文大学 | 2017-06-20 | — | — | CN | disclosed |
| CN-104987350-A | Chiral alpha-amino phosphonate ester compounds having anti-virus activity and containing benzothiazole heterocycle, preparation and applications thereof | UNIV GUIZHOU | 2015-10-21 | — | — | CN | disclosed |