Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5177986 | 0.89 | NOTUM (0.47) | NPSR1SMN1; SMN2TDP1MAPTKMT2A | |
| SCHEMBL4888764 | 0.87 | CTSS (0.43) | MAPTKMT2ATSHRPTGS2TP53 | |
| SCHEMBL8469388 | 0.82 | SCN5A (0.46) | NPSR1SMN1; SMN2TDP1MAPTKMT2A | |
| SCHEMBL5176779 | 0.80 | FFAR1 (0.46) | SMN1; SMN2MAPTKMT2AALDH1A1HTT | |
| SCHEMBL4888547 | 0.79 | CTSS (0.42) | TSHRTP53 | |
| SCHEMBL4890495 | 0.78 | CTSS (0.52) | MAPTALDH1A1HTTTSHRGAA | |
| SCHEMBL4884698 | 0.75 | MAPT (0.49) | SMN1; SMN2MAPTKMT2ATSHRPOLB | |
| SCHEMBL4884701 | 0.74 | SMN1; SMN2 (0.41) | NPSR1SMN1; SMN2TDP1MAPTKMT2A | |
| SCHEMBL4891052 | 0.72 | CA9 (0.51) | — | |
| SCHEMBL4888769 | 0.72 | S1PR1 (0.38) | SMN1; SMN2MAPTKMT2AALDH1A1HTT |
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-1778682-A1 | HETEROCYCLIC COMPOUNDS USEFUL AS DPP- IV INHIBITORS | Santhera Pharmaceuticals (Schweiz) AG (CH) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006013104-A1 | HETEROCYCLIC COMPOUNDS USEFUL AS DPP- IV INHIBITORS | SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) | 2006-02-09 | — | — | WO | disclosed |