Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 7/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 7/20 | 0.43 |
| ▸ | PTGES | O14684 | 4/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5804793 | 0.90 | AKR1C3 (0.40) | ALDH1A1KDM4EHTTEGFRERBB2 | |
| SCHEMBL5820745 | 0.84 | ALDH1A1 (0.44) | ALDH1A1KDM4EHTTMAPTPOLB | |
| SCHEMBL5809144 | 0.83 | MAPT (0.46) | ALDH1A1KDM4EHTTEGFRERBB2 | |
| SCHEMBL5807526 | 0.83 | EGFR (0.58) | ALDH1A1EGFRERBB2PTGESALOX5 | |
| SCHEMBL5807982 | 0.83 | PTGES (0.56) | ALDH1A1EGFRERBB2PTGESALOX5 | |
| SCHEMBL5804900 | 0.83 | MAPK13 (0.47) | ALDH1A1EGFRERBB2PTGESALOX5 | |
| SCHEMBL5806852 | 0.82 | ALDH1A1 (0.50) | ALDH1A1HTTEGFRERBB2PTGES | |
| SCHEMBL5804485 | 0.81 | EGFR (0.47) | EGFRERBB2PTGESALOX5MAPK13 | |
| SCHEMBL5808774 | 0.81 | ALDH1A1 (0.59) | ALDH1A1EGFRERBB2PTGESALOX5 | |
| SCHEMBL5807701 | 0.81 | MEN1 (0.41) | ALDH1A1HTTMAPTPOLBNPSR1 |
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-2006075955-A1 | PYRAZOLYL ACYLSULFONAMIDE DERIVATIVES AS ENDOTHELIN CONVERTING ENZYME INHIBITORS AND USEFUL IN THE TREATMENT OF CHRONIC OBSTRUCTIVE PULMONARY DISEASE | ASTRAZENECA AB (SE) | 2006-07-20 | — | — | WO | claimed |