Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29848178 | 1.00 | BTK (0.49) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL31470391 | 1.00 | BTK (0.49) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL19101715 | 0.87 | BTK (0.43) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL16391336 | 0.87 | KDM1A (0.46) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL18843783 | 0.87 | BTK (0.43) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL25087754 | 0.87 | BTK (0.43) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL19313966 | 0.87 | KDM1A (0.46) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL6737241 | 0.87 | BTK (0.43) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL5794427 | 0.87 | BTK (0.50) | BTKKDM1ANFKB1NFKB2RELA | |
| SCHEMBL12921432 | 0.87 | BTK (0.51) | BTKKDM1ANFKB1NFKB2RELA |
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-2023099648-A1 | PYRAOLO- AND TRIAZOLO-AZINONE COMPOUNDS AND THEIR USES | ASTRAZENECA AB (SE) | 2023-06-08 | — | — | WO | disclosed |