Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | PTPRF | P10586 | 1/20 | 0.33 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL5285030 | 0.84 | ALDH1A1 (0.52) | ALDH1A1ALOX15TSHRCES2CES1 | |
| SCHEMBL2409184 | 0.83 | TSHR (0.63) | ALDH1A1ALOX15TSHRMEN1KMT2A | |
| SCHEMBL30991215 | 0.81 | TSHR (0.41) | ALDH1A1TSHRMEN1KMT2ATDP1 | |
| SCHEMBL27867898 | 0.80 | ALDH1A1 (0.35) | ALDH1A1ALOX15TSHRMEN1KMT2A | |
| SCHEMBL6367716 | 0.80 | ALDH1A1 (0.45) | ALDH1A1ALOX15TSHRMEN1KMT2A | |
| SCHEMBL29929330 | 0.79 | ALDH1A1 (0.54) | ALDH1A1ALOX15MEN1KMT2ATDP1 | |
| SCHEMBL502454 | 0.79 | ALDH1A1 (0.54) | ALDH1A1ALOX15MEN1KMT2ATDP1 | |
| SCHEMBL27841955 | 0.78 | ALDH1A1 (0.43) | ALDH1A1ALOX15TSHRMEN1KMT2A | |
| SCHEMBL4924666 | 0.78 | ALDH1A1 (0.46) | ALDH1A1ALOX15TSHRMEN1KMT2A | |
| SCHEMBL2658695 | 0.78 | TSHR (0.38) | ALDH1A1TSHRMEN1KMT2ATDP1 |
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-105518014-B | C-aryl glucoside derivative, preparation method and application thereof in medicine | 上海研健新药研发有限公司 | 2018-03-23 | — | — | CN | disclosed |
| CN-107311992-A | C aryl glucosides derivative, its preparation method and its in application pharmaceutically | 上海研健新药研发有限公司 | 2017-11-03 | — | — | CN | disclosed |
| CN-105518014-A | C-aryl glucoside derivative, preparation method and application thereof in medicine | JIANGSU HANSOH PHARMACEUTICAL | 2016-04-20 | — | — | CN | disclosed |