Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 7/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 4/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767927 | 1.00 | BTK (0.36) | BTKIRAK4KDM4ECHRM4CYP3A4 | |
| SCHEMBL8485445 | 1.00 | BTK (0.36) | BTKIRAK4KDM4ECHRM4CYP3A4 | |
| SCHEMBL8766684 | 0.84 | BTK (0.37) | BTKIRAK4KDM4ECHRM4CYP3A4 | |
| SCHEMBL8483787 | 0.84 | BTK (0.37) | BTKIRAK4KDM4ECHRM4CYP3A4 | |
| SCHEMBL8746756 | 0.84 | BTK (0.41) | BTKIRAK4 | |
| SCHEMBL8746780 | 0.82 | BTK (0.46) | BTKIRAK4KDM4E | |
| SCHEMBL8746781 | 0.82 | BTK (0.46) | BTKIRAK4KDM4E | |
| SCHEMBL8746770 | 0.81 | BTK (0.47) | BTKIRAK4 | |
| SCHEMBL8914933 | 0.81 | BTK (0.47) | BTKIRAK4 | |
| SCHEMBL8487365 | 0.81 | BTK (0.42) | BTKIRAK4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0787128-A1 | SUBSTITUTED CYCLOALKYLAMINO AND CYCLOALKOXY HETEROCYCLES, PROCESS FOR PREPARING THE SAME AND THEIR USE AS PESTICIDES | Hoechst Schering AgrEvo GmbH (DE) | 1997-08-06 | — | — | EP | disclosed |
| WO-1996011913-A1 | SUBSTITUTED CYCLOALKYLAMINO AND CYCLOALKOXY HETEROCYCLES, PROCESS FOR PREPARING THE SAME AND THEIR USE AS PESTICIDES | HOECHST SCHERING AGREVO GMBH (DE) | 1996-04-25 | — | — | WO | disclosed |