Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.36 |
| ▸ | PPARG | P37231 | 4/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.33 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 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 | |
|---|---|---|---|---|
| SCHEMBL543323 | 1.00 | EPHX2 (0.36) | EPHX2PPARGTBXAS1HDAC4GAA | |
| SCHEMBL543640 | 0.83 | GAA (0.39) | TBXAS1GAAALDH1A1TGFBR1 | |
| SCHEMBL543641 | 0.83 | GAA (0.39) | TBXAS1GAAALDH1A1TGFBR1 | |
| SCHEMBL2779454 | 0.77 | TBXAS1 (0.39) | TBXAS1HDAC4P2RX7ALDH1A1TGFBR1 | |
| SCHEMBL2779451 | 0.77 | TBXAS1 (0.39) | TBXAS1HDAC4P2RX7ALDH1A1TGFBR1 | |
| SCHEMBL15769229 | 0.75 | HDAC4 (0.43) | EPHX2PPARGTBXAS1HDAC4PSEN1 | |
| SCHEMBL15769231 | 0.75 | HDAC4 (0.43) | EPHX2PPARGTBXAS1HDAC4PSEN1 | |
| SCHEMBL543321 | 0.75 | GAA (0.43) | GAA | |
| SCHEMBL10258079 | 0.75 | GAA (0.43) | GAA | |
| SCHEMBL543912 | 0.70 | EGLN2 (0.39) | EPHX2TBXAS1GAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8110585-B2 | Bicyclic compound and pharmaceutical use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-02-07 | — | — | US | disclosed |