Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL23930195 | 1.00 | CA12 (0.35) | CA12CA1CA2CA3PKM | |
| SCHEMBL30211269 | 0.88 | TSHR (0.34) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL30007783 | 0.86 | KDM4E (0.39) | CA12CA1CA2CA7CA9 | |
| SCHEMBL23930065 | 0.86 | KDM4E (0.39) | CA12CA1CA2CA7CA9 | |
| SCHEMBL23905575 | 0.83 | HCRTR1 (0.35) | CA12CA1CA2CA3PKM | |
| SCHEMBL23904745 | 0.82 | CA12 (0.50) | CA12CA1CA2CA3PKM | |
| SCHEMBL23905544 | 0.82 | HCAR2 (0.37) | CA12CA1CA2CA3PKM | |
| SCHEMBL30006713 | 0.81 | EGLN1 (0.35) | CA12CA1CA2CA3PKM | |
| SCHEMBL23958617 | 0.81 | EGLN1 (0.35) | CA12CA1CA2CA3PKM | |
| SCHEMBL23904799 | 0.80 | KMT2A (0.41) | CA12CA1CA2CA3PKM |
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-115461336-A | RSV inhibiting 3-substituted quinoline and cinnoline derivatives | 爱尔兰詹森科学公司 | 2022-12-09 | — | — | CN | disclosed |