Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA9 | Q16790 | 4/20 | 0.37 |
| ▸ | PREP | P48147 | 3/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16318652 | 0.79 | SMN1; SMN2 (0.32) | CA12CA1CA9BACE1 | |
| SCHEMBL16319169 | 0.77 | BACE1 (0.33) | BACE1 | |
| SCHEMBL16319029 | 0.75 | CA12 (0.39) | CA12CA1CA9PREP | |
| SCHEMBL2292629 | 0.73 | CA12 (0.44) | CA12CA1CA9PREP | |
| SCHEMBL14110450 | 0.73 | CA12 (0.48) | CA12CA1CA9PREP | |
| SCHEMBL2188571 | 0.72 | CA12 (0.43) | CA12CA1CA9PREP | |
| SCHEMBL9034920 | 0.72 | CA12 (0.43) | CA12CA1CA9PREP | |
| SCHEMBL15690979 | 0.69 | CA12 (0.43) | CA12CA1CA9PREP | |
| SCHEMBL17923729 | 0.69 | PREP (0.41) | CA12CA1CA9PREP | |
| SCHEMBL25227167 | 0.68 | ALDH1A1 (0.43) | BACE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9382188-B2 | Aromatic ring compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-07-05 | — | — | US | disclosed |
| EP-2816023-A1 | AROMATIC RING COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2014-12-24 | — | — | EP | disclosed |