Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL1891151 | 0.81 | ACHE (0.43) | APLNRACHEAGTR1 | |
| SCHEMBL13626562 | 0.79 | — | — | |
| SCHEMBL27771424 | 0.76 | CYP19A1 (0.37) | APLNRPARP1ACHEKDM4EALDH1A1 | |
| SCHEMBL13625909 | 0.75 | ACHE (0.34) | APLNRACHEAGTR1 | |
| SCHEMBL1889439 | 0.74 | ACHE (0.42) | APLNRACHEAGTR1 | |
| SCHEMBL3487184 | 0.73 | PARP1 (0.38) | APLNRPARP1ACHEAGTR1 | |
| SCHEMBL13626516 | 0.73 | AGTR1 (0.33) | APLNRACHEAGTR1KDM4EALDH1A1 | |
| SCHEMBL12348665 | 0.72 | ACHE (0.45) | APLNRACHEAGTR1 | |
| SCHEMBL1894561 | 0.72 | ACHE (0.45) | APLNRPARP1ACHEAGTR1 | |
| SCHEMBL1886429 | 0.71 | ACHE (0.43) | PARP1ACHEAGTR1 |
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 |