Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 5/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 10/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | TFEB | P19484 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11538838 | 0.87 | PTGES2 (0.59) | PTGES2NFE2L2KCNH2TFEBKDM4E | |
| SCHEMBL11538841 | 0.87 | PTGES2 (0.59) | PTGES2NFE2L2KCNH2TFEBKDM4E | |
| SCHEMBL2474418 | 0.74 | ERN1 (0.57) | NFE2L2TFEBNR1H3KDM4EALDH1A1 | |
| SCHEMBL28811626 | 0.71 | NFE2L2 (0.59) | PTGES2NFE2L2KCNH2TFEBKDM4E | |
| SCHEMBL13802795 | 0.71 | NFE2L2 (0.59) | PTGES2NFE2L2KCNH2TFEBKDM4E | |
| SCHEMBL3380244 | 0.71 | HTR6 (0.49) | PTGES2KDM4EALDH1A1MAPTACHE | |
| SCHEMBL28324605 | 0.71 | APP (0.47) | NFE2L2TFEBNR1H3KDM4EALDH1A1 | |
| SCHEMBL8038506 | 0.71 | APP (0.47) | NFE2L2TFEBNR1H3KDM4EALDH1A1 | |
| SCHEMBL301996 | 0.71 | CA1 (0.71) | KDM4EALDH1A1GAAMAPTL3MBTL1 | |
| SCHEMBL29429633 | 0.71 | CA1 (0.71) | KDM4EALDH1A1GAAMAPTL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896401-A2 | UNSATURATED SULFIDES, SULFONES, SULFOXIDES AND SULFONAMIDES SYNTHESIS | Temple University of the Commonwealth System of Higher Education (US) | 2008-03-12 | — | — | EP | claimed |
| WO-2006091870-A2 | UNSATURATED SULFIDES, SULFONES, SULFOXIDES AND SULFONAMIDES SYNTHESIS | TEMPLE UNIVERSITY- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2006-08-31 | — | — | WO | claimed |