Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 1/20 | 0.42 |
| ▸ | DHFR | P00374 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 8/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3802246 | 0.88 | AGXT (0.44) | AGXTDHFRDPP4GFERHSP90AA1 | |
| SCHEMBL3801363 | 0.87 | AGXT (0.41) | AGXTDHFRPDE10AHSP90AA1 | |
| SCHEMBL3801655 | 0.82 | AGXT (0.43) | AGXTDHFRPDE10A | |
| SCHEMBL191418 | 0.79 | AGXT (0.45) | AGXTDPP4PDE10AGFERHSP90AA1 | |
| SCHEMBL29382857 | 0.78 | AGXT (0.66) | AGXTPDE10AHSP90AA1 | |
| SCHEMBL1060082 | 0.78 | AGXT (0.66) | AGXTPDE10AHSP90AA1 | |
| SCHEMBL3796805 | 0.78 | AGXT (0.41) | AGXTDPP4GFERHSP90AA1 | |
| Hydrochloric Acid SCHEMBL3247161 | 0.77 | AGXT (0.64) | AGXTPDE10AHSP90AA1 | |
| SCHEMBL9688517 | 0.77 | AGXT (0.46) | AGXTDPP4GFER | |
| SCHEMBL10057999 | 0.75 | AGXT (0.62) | AGXTPDE10AHSP90AA1 |
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-2010117425-A1 | CERTAIN SUBSTITUTED PYRIMIDINES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | BIOGEN IDEC MA INC. (US) | 2010-10-14 | — | — | WO | disclosed |