Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14801762 | 1.00 | BTK (0.49) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL19021203 | 1.00 | BTK (0.49) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL15688823 | 0.86 | BTK (0.48) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL15428315 | 0.86 | BTK (0.48) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL22068700 | 0.86 | BTK (0.44) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL23583793 | 0.86 | BTK (0.48) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL19547113 | 0.86 | BTK (0.50) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL28547494 | 0.85 | GAA (0.49) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL15542360 | 0.84 | BTK (0.52) | BTKCTSKGAANFKB1NFKB2 | |
| SCHEMBL29180734 | 0.84 | BTK (0.52) | BTKCTSKGAANFKB1NFKB2 |
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-2016001789-A1 | PYRIMIDINE DERIVATIVES AS PI3K INHIBITORS FOR USE IN THE TREATMENT OF CANCER | PFIZER INC. (US) | 2016-01-07 | — | — | WO | disclosed |