Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.39 |
| ▸ | RELA | Q04206 | 4/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2314003 | 0.84 | GAA (0.58) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL6885957 | 0.84 | GAA (0.58) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL16782174 | 0.76 | GAA (0.46) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL15130755 | 0.74 | GAA (0.66) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL14861548 | 0.74 | GAA (0.61) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL20331988 | 0.71 | BTK (0.51) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL20960871 | 0.71 | BTK (0.51) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL1062209 | 0.71 | BTK (0.51) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL19089217 | 0.70 | GAA (0.50) | GAANFKB1NFKB2RELABTK | |
| SCHEMBL19790328 | 0.70 | CA1 (0.41) | GAANFKB1NFKB2RELABTK |
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-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |