Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 7/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28306170 | 1.00 | ALDH1A1 (0.47) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL28946153 | 0.84 | MAPT (0.44) | ALDH1A1HTTMAPTPOLB | |
| SCHEMBL18319457 | 0.81 | MAPT (0.63) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL482084 | 0.81 | MAPT (0.63) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL30154421 | 0.81 | MAPT (0.63) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL30154407 | 0.81 | MAPT (0.63) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL481628 | 0.81 | MAPT (0.63) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL28946163 | 0.80 | TXNRD1 (0.42) | ALDH1A1HTTMAPTNPSR1MAPK1 | |
| SCHEMBL28306187 | 0.79 | ALDH1A1 (0.48) | ALDH1A1GAAHTTCRHBPCRHR2 | |
| SCHEMBL28306264 | 0.79 | ALDH1A1 (0.48) | ALDH1A1GAAHTTCRHBPCRHR2 |
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-109970633-B | Pyridine sulfone and derivative, preparation method and application thereof | 湖南化工研究院有限公司 | 2022-12-27 | — | — | CN | claimed |
| CN-109970633-A | Pyridine sulfone and its derivative, preparation method and application | 湖南化工研究院有限公司 | 2019-07-05 | — | — | CN | claimed |
| CN-109970633-B | Pyridine sulfone and derivative, preparation method and application thereof | 湖南化工研究院有限公司 | 2022-12-27 | — | — | CN | disclosed |
| CN-109970633-A | Pyridine sulfone and its derivative, preparation method and application | 湖南化工研究院有限公司 | 2019-07-05 | — | — | CN | disclosed |