Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.39 |
| ▸ | RELA | Q04206 | 4/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19807767 | 0.83 | BTK (0.47) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL3375340 | 0.80 | BTK (0.43) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL15759282 | 0.78 | BTK (0.42) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL3377169 | 0.75 | KDM1A (0.39) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL24573830 | 0.75 | BTK (0.50) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL18459571 | 0.75 | BTK (0.50) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL16021094 | 0.75 | BTK (0.50) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL20467867 | 0.75 | BTK (0.50) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL17718433 | 0.75 | BTK (0.50) | BTKNFKB1NFKB2RELACTSK | |
| SCHEMBL3374188 | 0.75 | NFKB1 (0.40) | BTKNFKB1NFKB2RELACTSK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012000608-A2 | NOVEL BETA-AMINOALDEHYDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR CHEMICAL USE AS REACTIVE INTERMEDIATES | GLUESENKAMP KARL-HEINZ (DE) | 2012-01-05 | — | — | WO | disclosed |