Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 2/20 | 0.42 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4041725 | 0.94 | CACNA1B (0.41) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL4045987 | 0.89 | HDAC3 (0.41) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL4045889 | 0.85 | CACNA1B (0.43) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL4047340 | 0.84 | PPARG (0.44) | ALDH1A1MAOBMAOAESR1 | |
| SCHEMBL4046658 | 0.83 | CACNA1B (0.44) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL6204224 | 0.81 | TYMS (0.37) | ALDH1A1KDM4ESMN1; SMN2TYMS | |
| SCHEMBL4046122 | 0.80 | CACNA1B (0.43) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL4044883 | 0.79 | CACNA1B (0.43) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL5414630 | 0.78 | CACNA1B (0.40) | CACNA1BCACNA1HHDAC3HDAC1HDAC2 | |
| SCHEMBL4043160 | 0.78 | PPARG (0.43) | ALDH1A1SMN1; SMN2MAOBMAOAESR1 |
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-1603921-B1 | THIADIBENZOAZULENE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES | GLAXOSMITHKLINE ZAGREB (HR) | 2009-06-17 | — | — | EP | claimed |