Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.46 |
| ▸ | RELA | Q04206 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | KCNA3 | P22001 | 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 | |
|---|---|---|---|---|
| SCHEMBL22776716 | 0.88 | BTK (0.48) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL28870402 | 0.88 | BTK (0.48) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL28310040 | 0.86 | BTK (0.49) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL9078331 | 0.85 | NFKB1 (0.49) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL28539529 | 0.83 | GAA (0.50) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL15285432 | 0.80 | NFKB1 (0.41) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL26873668 | 0.80 | EPHX2 (0.46) | BTKNFKB1NFKB2RELAGAA | |
| Bicarbonate SCHEMBL187492 | 0.78 | BTK (0.62) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL24643192 | 0.78 | CTSK (0.54) | BTKNFKB1NFKB2RELAGAA | |
| SCHEMBL570801 | 0.77 | GAA (0.54) | BTKNFKB1NFKB2RELAGAA |
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-114599654-B | ACC inhibitor and application thereof | 南京瑞捷医药科技有限公司 | 2023-07-04 | — | — | CN | disclosed |