Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL24340475 | 1.00 | BTK (0.47) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL12528056 | 0.89 | BTK (0.48) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL509300 | 0.89 | BTK (0.48) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL24424554 | 0.82 | BTK (0.43) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL13035982 | 0.80 | BTK (0.51) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL18929028 | 0.80 | BTK (0.51) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL14251619 | 0.80 | BTK (0.46) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL14251624 | 0.80 | BTK (0.46) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL14251622 | 0.80 | BTK (0.46) | BTKCTSKGAAEPHX1KDM1A | |
| SCHEMBL10343938 | 0.79 | BTK (0.61) | BTKCTSKGAAEPHX1KDM1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115003671-A | JNK inhibitors, pharmaceutical compositions and uses thereof | 武汉朗来科技发展有限公司 | 2022-09-02 | — | — | CN | disclosed |
| WO-2022048684-A1 | JNK INHIBITOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | 武汉朗来科技发展有限公司 | 2022-03-10 | — | — | WO | disclosed |