Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | CASR | P41180 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.42 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31127313 | 1.00 | CA1 (0.55) | CA1CA2CA7CA9CASR | |
| SCHEMBL4633089 | 0.86 | CA1 (0.57) | CA1CA2CA7CA9CASR | |
| SCHEMBL4407591 | 0.86 | CA1 (0.57) | CA1CA2CA7CA9CASR | |
| SCHEMBL30819056 | 0.85 | CA1 (0.55) | CA1CA2CA7CA9CASR | |
| SCHEMBL11922728 | 0.85 | CA1 (0.55) | CA1CA2CA7CA9CASR | |
| SCHEMBL30819084 | 0.85 | CA1 (0.55) | CA1CA2CA7CA9CASR | |
| SCHEMBL24473808 | 0.83 | CA1 (0.60) | CA1CA2CA7CA9CASR | |
| SCHEMBL17005403 | 0.83 | CA1 (0.60) | CA1CA2CA7CA9CASR | |
| SCHEMBL2810250 | 0.83 | CA1 (0.60) | CA1CA2CA7CA9CASR | |
| SCHEMBL7063100 | 0.79 | CA1 (0.68) | CA1CA2CA7CA9MAPK1 |
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-117777048-B | Preparation method of chiral 2-hydroxymethylmorpholine-4-carboxylic acid tert-butyl ester | 上海科利生物医药有限公司 | 2024-09-20 | — | — | CN | disclosed |
| CN-117777048-A | Preparation method of chiral 2-hydroxymethylmorpholine-4-carboxylic acid tert-butyl ester | 上海科利生物医药有限公司 | 2024-03-29 | — | — | CN | disclosed |