Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA4 | P22748 | 3/20 | 0.43 |
| ▸ | CA6 | P23280 | 3/20 | 0.43 |
| ▸ | CA5A | P35218 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | MET | P08581 | 3/20 | 0.43 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 4/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 3/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3437306 | 0.89 | CA12 (0.51) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL3437320 | 0.88 | CA12 (0.52) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL22219379 | 0.84 | CA12 (0.46) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL22219380 | 0.84 | CA12 (0.46) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL3437307 | 0.83 | CA12 (0.46) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL3437297 | 0.82 | MET (0.58) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL3437285 | 0.82 | MET (0.58) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL18926017 | 0.81 | CA12 (0.46) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL13750820 | 0.81 | THRB (0.51) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL3437309 | 0.81 | THRB (0.47) | PPARAAKR1B10AKR1B1THRBAPP |
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 |
|---|---|---|---|---|---|---|---|
| EP-3239273-B1 | NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME | DAINIPPON INK & CHEMICALS (JP) | 2019-11-13 | — | — | EP | disclosed |