Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24149776 | 1.00 | CA12 (0.41) | CA12CA1CA2TYRCA7 | |
| SCHEMBL6296330 | 0.77 | NLRP3 (0.39) | KMT2AMEN1ALDH1A1NLRP3TGFBR1 | |
| SCHEMBL6296329 | 0.77 | NLRP3 (0.39) | KMT2AMEN1ALDH1A1NLRP3TGFBR1 | |
| SCHEMBL24149773 | 0.77 | TGFBR1 (0.39) | KMT2AMEN1ALDH1A1NLRP3TGFBR1 | |
| SCHEMBL5671760 | 0.73 | HDAC1 (0.52) | CA12CA1CA2TYRCA7 | |
| SCHEMBL5671756 | 0.73 | HDAC1 (0.52) | CA12CA1CA2TYRCA7 | |
| SCHEMBL7301257 | 0.71 | JAK2 (0.50) | CA12CA1CA2TYRCA7 | |
| SCHEMBL7301264 | 0.71 | JAK2 (0.50) | CA12CA1CA2TYRCA7 | |
| SCHEMBL19836882 | 0.71 | MAPT (0.34) | ALDH1A1NLRP3TGFBR1SMN1; SMN2KDM4E | |
| SCHEMBL19836880 | 0.71 | MAPT (0.34) | ALDH1A1NLRP3TGFBR1SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-117355521-A | Heteroaryl inhibitors of plasma kallikrein | 武田药品工业株式会社 | 2024-01-05 | — | — | CN | disclosed |