Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10153346 | 0.84 | CHRNA7 (0.53) | BTKCTSKCA1CA2CHRNA7 | |
| SCHEMBL10189601 | 0.84 | CHRNA7 (0.50) | BTKCTSKCA1CA2NFKB1 | |
| SCHEMBL424987 | 0.84 | CHRNA7 (0.50) | BTKCTSKCA1CA2NFKB1 | |
| SCHEMBL421147 | 0.84 | CHRNA7 (0.53) | BTKCTSKCA1CA2CHRNA7 | |
| SCHEMBL424988 | 0.84 | CHRNA7 (0.50) | BTKCTSKCA1CA2NFKB1 | |
| SCHEMBL421148 | 0.84 | CHRNA7 (0.53) | BTKCTSKCA1CA2CHRNA7 | |
| SCHEMBL20063738 | 0.83 | CHRNA7 (0.55) | BTKCTSKCA1CA2CHRNA7 | |
| SCHEMBL31021493 | 0.83 | CHRNA7 (0.52) | BTKCTSKCA1CA2CHRNA7 | |
| SCHEMBL12714581 | 0.79 | BTK (0.53) | BTKCTSKKDM1ACA1CA2 | |
| SCHEMBL12439638 | 0.79 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113166174-A | Free amino compounds for the treatment and prevention of bacterial infections | 豪夫迈·罗氏有限公司 | 2021-07-23 | — | — | CN | disclosed |
| US-5599816-A | BACTERICIDE | ABBOTT LABORATORIES (US) | 1997-02-04 | — | — | US | disclosed |
| WO-1996039407-A1 | QUINOLIZINONE TYPE COMPOUNDS | ABBOTT LABORATORIES (US) | 1996-12-12 | — | — | WO | disclosed |