Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18390617 | 0.77 | HTR2A (0.42) | DPP4 | |
| SCHEMBL23138574 | 0.74 | DPP4 (0.33) | DPP4 | |
| SCHEMBL23138568 | 0.74 | DPP4 (0.33) | DPP4 | |
| SCHEMBL24703358 | 0.71 | DPP4 (0.34) | DPP4 | |
| SCHEMBL21739492 | 0.71 | DPP4 (0.32) | DPP4 | |
| SCHEMBL21739320 | 0.71 | DPP4 (0.34) | DPP4 | |
| SCHEMBL24703359 | 0.71 | DPP4 (0.32) | DPP4 | |
| SCHEMBL26450622 | 0.71 | DPP4 (0.34) | DPP4 | |
| SCHEMBL761295 | 0.71 | NOS1 (0.42) | — | |
| SCHEMBL24629551 | 0.71 | HTR2A (0.37) | DPP4 |
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-2022269508-A1 | PYRAZOLYL DERIVATIVES AS INHIBITORS OF THE KRAS MUTANT PROTEIN | NOVARTIS AG (CH) | 2022-12-29 | — | — | WO | disclosed |