Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA4 | P22748 | 2/20 | 0.55 |
| ▸ | CA6 | P23280 | 2/20 | 0.55 |
| ▸ | CA5A | P35218 | 2/20 | 0.55 |
| ▸ | CA7 | P43166 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.55 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.55 |
| ▸ | AKR1B10 | O60218 | 6/20 | 0.53 |
| ▸ | AKR1B1 | P15121 | 6/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | TTR | P02766 | 3/20 | 0.46 |
| ▸ | MET | P08581 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28519785 | 1.00 | CA12 (0.55) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28515562 | 0.86 | LMNA (0.56) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28515564 | 0.86 | LMNA (0.56) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28516046 | 0.84 | LMNA (0.53) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28516044 | 0.84 | LMNA (0.53) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28907183 | 0.81 | CA12 (0.58) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28907185 | 0.81 | CA12 (0.58) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL1878873 | 0.81 | CA12 (0.58) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL1878870 | 0.81 | CA12 (0.58) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL28993123 | 0.81 | KDM4E (0.64) | CA12CA4CA6CA5ACA7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108191656-B | Method for cross dehydrogenation coupling of aromatic carboxylic acid and alpha, beta-unsaturated ester | 陕西师范大学 | 2021-02-02 | — | — | CN | disclosed |