Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.50 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.49 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.49 |
| ▸ | ITGAL | P20701 | 3/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | REN | P00797 | 1/20 | 0.42 |
| ▸ | MME | P08473 | 1/20 | 0.42 |
| ▸ | ECE1 | P42892 | 1/20 | 0.42 |
| ▸ | CAPN1 | P07384 | 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 | |
|---|---|---|---|---|
| SCHEMBL11158707 | 0.84 | ITGB2 (0.58) | CA1CA2AGTR2ITGB2ICAM1 | |
| SCHEMBL4525493 | 0.81 | CA1 (0.72) | CA1CA2AGTR2ITGB2ICAM1 | |
| SCHEMBL1394395 | 0.79 | CA1 (0.62) | CA1CA2AGTR2ITGB2ICAM1 | |
| SCHEMBL28287129 | 0.78 | ALDH1A1 (0.47) | CA1CA2 | |
| SCHEMBL29270314 | 0.77 | CYP3A4 (0.58) | — | |
| SCHEMBL4070765 | 0.74 | AGTR2 (0.54) | CA1CA2AGTR2ITGB2ICAM1 | |
| SCHEMBL28871451 | 0.74 | ALDH1A1 (0.43) | CA1CA2 | |
| SCHEMBL94828 | 0.73 | CA1 (0.55) | CA1CA2AGTR2ITGB2ICAM1 | |
| SCHEMBL96251 | 0.73 | CA1 (0.60) | CA1CA2AGTR2ITGB2ICAM1 | |
| SCHEMBL10658536 | 0.71 | CA1 (0.71) | CA1CA2AGTR2ITGB2ICAM1 |
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-109524698-A | One kind being based on thiocarbamide carboxylic acids metal organic frame/Nafion polymer hybrid proton exchange membrane and preparation method thereof | 中能源工程集团氢能科技有限公司 | 2019-03-26 | — | — | CN | disclosed |