Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8556572 | 0.82 | PTGS2 (0.41) | PTGS1PTGS2ALOX5NFE2L2ACHE | |
| SCHEMBL29432845 | 0.77 | ALDH1A1 (0.48) | PTGS1PTGS2NFE2L2MEN1KMT2A | |
| SCHEMBL16950812 | 0.77 | PTGS1 (0.41) | PTGS1PTGS2ALOX5NFE2L2ACHE | |
| SCHEMBL41736 | 0.77 | ALDH1A1 (0.48) | PTGS1PTGS2NFE2L2MEN1KMT2A | |
| SCHEMBL12958097 | 0.77 | MEN1 (0.37) | PTGS1PTGS2ALOX5NFE2L2ACHE | |
| SCHEMBL8879774 | 0.76 | ALOX5 (0.52) | PTGS1PTGS2ALOX5MEN1KMT2A | |
| SCHEMBL19337428 | 0.76 | F2RL1 (0.41) | PTGS1PTGS2ALOX5NFE2L2MEN1 | |
| SCHEMBL7820969 | 0.73 | CYP3A4 (0.46) | PTGS1PTGS2ALOX5 | |
| SCHEMBL4031066 | 0.73 | NFE2L2 (0.36) | NFE2L2 | |
| SCHEMBL20651216 | 0.71 | PTGS1 (0.37) | PTGS1PTGS2ALOX5NFE2L2MEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1114823-A2 | Substituted benzylamino nitrogen containing non-aromatic heterocycles | PFIZER INC. (US) | 2001-07-11 | — | — | EP | disclosed |
| US-5721255-A | Substituted benzylamino nitrogen containing non-aromatic heterocycles | PFIZER INC. (US) | 1998-02-24 | — | — | US | disclosed |
| EP-0655996-A1 | SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES | PFIZER INC. (US) | 1995-06-07 | — | — | EP | disclosed |
| WO-1994004496-A9 | SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES | — | 1995-01-26 | — | — | WO | disclosed |
| WO-1994004496-A1 | SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES | PFIZER INC. (US) | 1994-03-03 | — | — | WO | disclosed |