Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.47 |
| ▸ | SDHB | P21912 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13450400 | 0.83 | PTGS2 (0.52) | PTGS2HDAC6KDM4EMEN1ALDH1A1 | |
| SCHEMBL3152021 | 0.81 | PTGS2 (0.48) | PTGS2HDAC6KDM4EMEN1ALDH1A1 | |
| SCHEMBL28897163 | 0.73 | PTGS2 (0.60) | PTGS2HDAC6MEN1KMT2APTGS1 | |
| SCHEMBL3166344 | 0.73 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL3172171 | 0.73 | PTGS2 (0.47) | PTGS2HDAC6PTGS1 | |
| SCHEMBL3151912 | 0.72 | PTGS2 (0.62) | PTGS2HDAC6KMT2APTGS1 | |
| SCHEMBL14002197 | 0.72 | PTGS1 (0.50) | PTGS2PTGS1SDHB | |
| SCHEMBL19243065 | 0.71 | THRB (0.54) | PTGS2HDAC6 | |
| SCHEMBL3161223 | 0.71 | PTGS2 (0.65) | PTGS2KDM4EALDH1A1PTGS1 | |
| SCHEMBL1357752 | 0.71 | PTGS2 (0.67) | PTGS2HDAC6HSP90AA1PTGS1 |
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-1546107-B1 | COX-2 INHIBITING PYRIDINE DERIVATIVES | GLAXO GROUP LTD (GB) | 2010-03-31 | — | — | EP | disclosed |