Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1156652 | 0.78 | KDM4E (0.35) | PTGS2PTGS1 | |
| SCHEMBL27744004 | 0.77 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL27723434 | 0.77 | RECQL (0.34) | PTGS2PTGS1 | |
| SCHEMBL27744045 | 0.72 | TSHR (0.30) | PTGS2 | |
| SCHEMBL1156235 | 0.68 | KDM4E (0.51) | — | |
| SCHEMBL1156805 | 0.66 | THRB (0.41) | PTGS2 | |
| SCHEMBL1156166 | 0.65 | KDM4E (0.61) | — | |
| SCHEMBL1156740 | 0.65 | KDM4E (0.37) | PTGS2 | |
| SCHEMBL27723250 | 0.65 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL1156374 | 0.64 | KDM4E (0.41) | PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101300229-B | 1-heterocyclylsulfonyl, 2-aminomethyl, 5- (hetero-) aryl substituted 1-h-pyrrole derivatives as acid secretion inhibitors | TAKEDA PHARMACEUTICAL | 2011-10-05 | — | — | CN | disclosed |
| CN-101300229-A | 1-heterocyclylsulfonyl, 2-aminomethyl, 5- (hetero-) aryl substituted 1-h-pyrrole derivatives as acid secretion inhibitors | TAKEDA PHARMACEUTICAL (JP) | 2008-11-05 | — | — | CN | disclosed |