Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 2/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 3/20 | 0.32 |
| ▸ | SLC33A1 | O00400 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2845819 | 0.83 | SLC33A1 (0.44) | AGTR1AGTR2SLC33A1ACHE | |
| SCHEMBL13625909 | 0.81 | ACHE (0.34) | AGTR1APLNRACHE | |
| SCHEMBL27792509 | 0.77 | AGTR1 (0.38) | AGTR1AGTR2SLC33A1 | |
| SCHEMBL13625877 | 0.73 | APLNR (0.33) | AGTR1APLNRACHEKDM4EALDH1A1 | |
| SCHEMBL1893594 | 0.71 | SLC33A1 (0.40) | SLC33A1 | |
| SCHEMBL13625938 | 0.70 | ALDH1A1 (0.34) | KDM4EALDH1A1 | |
| SCHEMBL2865020 | 0.70 | PPARG (0.51) | AGTR1ACHE | |
| SCHEMBL1892024 | 0.69 | SLC33A1 (0.64) | AGTR1SLC33A1 | |
| SCHEMBL12348905 | 0.69 | AGTR1 (0.47) | AGTR1AGTR2SLC33A1 | |
| SCHEMBL1892936 | 0.69 | SLC33A1 (0.63) | AGTR1SLC33A1 |
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-2009133970-A1 | CRYSTALLINE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-05 | — | — | WO | disclosed |