Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.63 |
| ▸ | DPP4 | P27487 | 9/20 | 0.63 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CASR | P41180 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3425489 | 0.89 | CYP3A4 (0.61) | CYP3A4DPP4NOX4MAPK14GRIN1 | |
| SCHEMBL3425219 | 0.78 | DPP4 (1.00) | CYP3A4DPP4 | |
| SCHEMBL3421937 | 0.78 | DPP4 (1.00) | CYP3A4DPP4 | |
| SCHEMBL3425757 | 0.77 | CYP3A4 (0.63) | CYP3A4DPP4NOX4GRIN1GRIN2B | |
| SCHEMBL3428161 | 0.75 | DPP4 (0.61) | CYP3A4DPP4NOX4GRIN1GRIN2B | |
| SCHEMBL6216570 | 0.73 | — | — | |
| SCHEMBL3423901 | 0.73 | DPP4 (0.57) | CYP3A4DPP4NOX4KMT2AMAPT | |
| SCHEMBL3425852 | 0.73 | CYP3A4 (0.63) | CYP3A4DPP4NOX4GRIN1GRIN2B | |
| SCHEMBL3426403 | 0.70 | NOX4 (0.47) | CYP3A4DPP4NOX4GRIN1GRIN2B | |
| SCHEMBL3423226 | 0.70 | DPP4 (0.64) | CYP3A4DPP4NOX4MAPK14GRIN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1608317-A4 | DIPEPTIDYL PEPTIDASE INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2006-12-27 | — | — | EP | claimed |
| EP-1608317-A2 | DIPEPTIDYL PEPTIDASE INHIBITORS | Takeda San Diego, Inc. (US) | 2005-12-28 | — | — | EP | claimed |
| WO-2004087053-A2 | DIPEPTIDYL PEPTIDASE INHIBITORS | SYRRX, INC. (US) | 2004-10-14 | — | — | WO | claimed |