Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 1/20 | 0.45 |
| ▸ | PDXK | O00764 | 2/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | BRS3 | P32247 | 2/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | WDR5 | P61964 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.30 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.30 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30703837 | 0.79 | AGXT (0.35) | AGXTPDXK | |
| SCHEMBL1060082 | 0.77 | AGXT (0.66) | AGXTBRS3FTOCYP2C9WDR5 | |
| SCHEMBL29382857 | 0.77 | AGXT (0.66) | AGXTBRS3FTOCYP2C9WDR5 | |
| SCHEMBL9688517 | 0.75 | AGXT (0.46) | AGXTDPP4GFERATP1A1ATP1B1 | |
| Hydrochloric Acid SCHEMBL3247161 | 0.75 | AGXT (0.64) | AGXTBRS3FTOCYP2C9WDR5 | |
| SCHEMBL22890261 | 0.74 | NPSR1 (0.37) | MGAMGAASIMGAM2KDM4E | |
| SCHEMBL191985 | 0.74 | AGXT (0.45) | AGXTDPP4BRS3FTOWDR5 | |
| SCHEMBL191418 | 0.74 | AGXT (0.45) | AGXTDPP4BRS3GFERWDR5 | |
| SCHEMBL3793502 | 0.73 | AGXT (0.41) | AGXTDPP4 | |
| SCHEMBL3802246 | 0.72 | AGXT (0.44) | AGXTPDXKDPP4GFERKMT2A |
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 |