Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 4/20 | 0.52 |
| ▸ | ESR1 | P03372 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30267536 | 1.00 | ESR2 (0.52) | ESR2ESR1MEN1MAPTKMT2A | |
| SCHEMBL28429828 | 0.93 | ESR1 (0.62) | ESR2ESR1MEN1MAPTKMT2A | |
| SCHEMBL30267283 | 0.93 | ESR1 (0.62) | ESR2ESR1MEN1MAPTKMT2A | |
| SCHEMBL2068058 | 0.86 | PTPN22 (0.52) | MEN1MAPTKMT2AHSP90AA1KDM4E | |
| SCHEMBL29364830 | 0.86 | PTPN22 (0.52) | MEN1MAPTKMT2AHSP90AA1KDM4E | |
| SCHEMBL21360075 | 0.86 | ESR2 (0.62) | ESR2ESR1MEN1MAPTKMT2A | |
| SCHEMBL29506854 | 0.86 | ESR2 (0.62) | ESR2ESR1MEN1MAPTKMT2A | |
| SCHEMBL28432478 | 0.81 | THRB (0.45) | MEN1MAPTKMT2AHSP90AA1KDM4E | |
| SCHEMBL30267558 | 0.81 | THRB (0.45) | MEN1MAPTKMT2AHSP90AA1KDM4E | |
| SCHEMBL18736016 | 0.77 | ALOX5 (0.66) | ESR2ESR1HSD17B1HSD17B2CYP1A2 |
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-111423332-B | Method for splitting chiral compound | 上海科技大学 | 2023-02-10 | — | — | CN | disclosed |
| CN-111423332-A | Method for splitting chiral compound | 上海科技大学 | 2020-07-17 | — | — | CN | disclosed |