Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 7/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.42 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.42 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.42 |
| ▸ | CLPP | Q16740 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3389261 | 0.82 | DPP4 (0.57) | DPP4KMT2AGRIN1GRIN2BNOX4 | |
| SCHEMBL3391390 | 0.78 | DPP4 (0.58) | DPP4KMT2AGRIN1GRIN2BNOX4 | |
| SCHEMBL8438720 | 0.77 | KMT2A (0.53) | DPP4KMT2AGRIN1GRIN2BNOX4 | |
| SCHEMBL3423901 | 0.74 | DPP4 (0.57) | DPP4KMT2ANOX4 | |
| SCHEMBL3424634 | 0.73 | KMT2A (0.46) | DPP4KMT2AGRIN1GRIN2BNOX4 | |
| SCHEMBL16152590 | 0.73 | DPP4 (0.61) | DPP4KMT2ANOX4NPBWR1MAPK1 | |
| SCHEMBL16201107 | 0.73 | TP53 (0.42) | DPP4KMT2AGRIN1GRIN2BNOX4 | |
| SCHEMBL3391369 | 0.72 | DPP4 (0.58) | DPP4KMT2AGRIN1GRIN2BNOX4 | |
| SCHEMBL555383 | 0.72 | DPP4 (0.61) | DPP4KMT2ATP53 | |
| SCHEMBL3424636 | 0.72 | KMT2A (0.47) | DPP4KMT2AGRIN1GRIN2BNOX4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005016911-A1 | 4-PYRIMIDONE DERIVATIVES AND THEIR USE AS PEPTIDYL PEPTIDASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-02-24 | — | — | WO | disclosed |