Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 9/20 | 0.43 |
| ▸ | CA2 | P00918 | 9/20 | 0.43 |
| ▸ | CA7 | P43166 | 6/20 | 0.43 |
| ▸ | CA9 | Q16790 | 6/20 | 0.43 |
| ▸ | CA12 | O43570 | 4/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15385513 | 1.00 | GAA (0.50) | GAAHTTKDM4EPOLBCA1 | |
| SCHEMBL435448 | 0.91 | CCR2 (0.43) | GAAALDH1A1HSD11B1GPR88 | |
| SCHEMBL10083346 | 0.91 | CCR2 (0.43) | GAAALDH1A1HSD11B1GPR88 | |
| SCHEMBL435831 | 0.89 | HSD11B1 (0.50) | GAAHTTALDH1A1L3MBTL1HSD11B1 | |
| SCHEMBL15385492 | 0.89 | HSD11B1 (0.50) | GAAHTTALDH1A1L3MBTL1HSD11B1 | |
| SCHEMBL434277 | 0.88 | ALDH1A1 (0.44) | GAAHTTKDM4EALDH1A1GPR88 | |
| SCHEMBL10083025 | 0.88 | ALDH1A1 (0.44) | GAAHTTKDM4EALDH1A1GPR88 | |
| Hydrochloric Acid SCHEMBL15380695 | 0.88 | HSD11B1 (0.49) | HTTPOLBALDH1A1L3MBTL1HSD11B1 | |
| Hydrochloric Acid SCHEMBL434246 | 0.88 | HSD11B1 (0.49) | HTTPOLBALDH1A1L3MBTL1HSD11B1 | |
| SCHEMBL15386629 | 0.86 | RPS6KB1 (0.44) | HTTALDH1A1L3MBTL1HSD11B1GPR88 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012012410-A2 | KAPPA OPIOID RECEPTOR AGONISTS | DR. REDDY'S LABORATORIES LTD. (IN) | 2012-01-26 | — | — | WO | disclosed |