Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 12/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.50 |
| ▸ | MMP14 | P50281 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.50 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28471201 | 0.86 | HSP90AA1 (0.62) | COMTHSP90AA1MMP14KDM4EMEN1 | |
| SCHEMBL7689814 | 0.86 | COMT (0.57) | COMTHSP90AA1MMP14KDM4EMEN1 | |
| SCHEMBL4461500 | 0.82 | COMT (0.64) | COMTHSP90AA1ALDH1A1ALOX15FTO | |
| SCHEMBL11274678 | 0.79 | COMT (0.73) | COMTHSP90AA1KDM4EALDH1A1LMNA | |
| SCHEMBL17962414 | 0.77 | COMT (0.45) | COMTHSP90AA1FTO | |
| SCHEMBL181076 | 0.75 | MPL (0.45) | HSP90AA1KDM4EMEN1ALDH1A1HTT | |
| SCHEMBL23379789 | 0.75 | MEN1 (0.50) | COMTHSP90AA1MEN1ALDH1A1ALOX15 | |
| SCHEMBL7692881 | 0.75 | ALDH1A1 (0.53) | COMTHSP90AA1KDM4EALDH1A1LMNA | |
| SCHEMBL22802119 | 0.75 | COMT (0.67) | COMTHSP90AA1MMP14KDM4EMEN1 | |
| SCHEMBL10908982 | 0.75 | MEN1 (0.64) | COMTHSP90AA1MMP14KDM4EMEN1 |
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-2008129276-A1 | DISULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-10-30 | — | — | WO | disclosed |