Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP2 | O95551 | 2/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 2/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SDCBP | O00560 | 1/20 | 0.34 |
| ▸ | SDC2 | P34741 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28534753 | 1.00 | CA1 (0.41) | CA1CA2CA4CA7CA9 | |
| SCHEMBL28532993 | 0.89 | CA1 (0.41) | CA1CA2CA4CA7CA9 | |
| SCHEMBL28547714 | 0.89 | CA1 (0.41) | CA1CA2CA4CA7CA9 | |
| SCHEMBL28600522 | 0.84 | CA1 (0.42) | CA1CA2CA4CA7CA9 | |
| SCHEMBL1875543 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2SRD5A1SRD5A2METAP1SDCBP | |
| SCHEMBL30293721 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2SRD5A1SRD5A2METAP1SDCBP | |
| SCHEMBL29476750 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2SRD5A1SRD5A2METAP1SDCBP | |
| SCHEMBL1874449 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2SRD5A1SRD5A2METAP1SDCBP | |
| SCHEMBL29476749 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2SRD5A1SRD5A2METAP1SDCBP | |
| SCHEMBL29940608 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2SRD5A1SRD5A2METAP1SDCBP |
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-114082446-B | Chiral zirconium catalyst for preparing chiral alpha-hydroxy-beta-keto ester compound and preparation method thereof | 南开沧州渤海新区绿色化工研究有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-114082446-A | Chiral zirconium catalyst for preparing chiral alpha-hydroxy-beta-keto ester compound and preparation method thereof | 南开沧州渤海新区绿色化工研究有限公司 | 2022-02-25 | — | — | CN | disclosed |
| CN-108516937-B | Method for preparing chiral alpha-hydroxy-beta-keto ester compound by visible light-initiated aerobic Salan-copper catalyst | 大连理工大学 | 2021-03-26 | — | — | CN | disclosed |