Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 9/20 | 0.61 |
| ▸ | ESR1 | P03372 | 8/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.61 |
| ▸ | MAOB | P27338 | 1/20 | 0.61 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | PTPRC | P08575 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | P4HB | P07237 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | USP7 | Q93009 | 1/20 | 0.41 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5817037 | 1.00 | ESR2 (0.61) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL5811756 | 0.92 | ESR2 (0.61) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL30004162 | 0.92 | ESR2 (0.61) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL18992188 | 0.84 | BCL2 (0.58) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL8663184 | 0.81 | ESR2 (0.44) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL10086888 | 0.80 | CA9 (0.44) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL21013875 | 0.80 | TGM2 (0.39) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL30490 | 0.80 | S100A4 (0.57) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL12822632 | 0.80 | ESR2 (0.57) | ESR2ESR1MAOAUGT1A1MAOB | |
| SCHEMBL29404998 | 0.80 | MAOA (0.53) | ESR2ESR1MAOAUGT1A1MAOB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117813710-A | Aqueous electrolyte, salt used therein, and redox flow battery using same | 三菱化学株式会社 | 2024-04-02 | — | — | CN | disclosed |
| CN-107847466-B | Formulations and methods for modulating wound healing | 贝欧曼蒂克丝公司 | 2024-02-06 | — | — | CN | disclosed |
| CN-114195814-B | Hydroxy naphthalenone-phenylboronic acid compound, preparation method and application | 中国药科大学 | 2023-07-21 | — | — | CN | disclosed |
| CN-114195814-A | Hydroxy naphthalenone-phenylboronic acid compound, preparation method and application | 中国药科大学 | 2022-03-18 | — | — | CN | disclosed |