Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 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 | |
|---|---|---|---|---|
| SCHEMBL22203922 | 1.00 | BTK (0.45) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL24439188 | 0.90 | BTK (0.44) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL16611529 | 0.85 | GAA (0.43) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL15191538 | 0.85 | BTK (0.44) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL24821867 | 0.85 | BTK (0.44) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL12493050 | 0.85 | BTK (0.44) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL12493337 | 0.84 | BTK (0.43) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL2493608 | 0.83 | BTK (0.46) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL5800481 | 0.82 | BTK (0.44) | BTKGAAEPHX1NFKB1NFKB2 | |
| SCHEMBL8315143 | 0.82 | BTK (0.44) | BTKGAAEPHX1NFKB1NFKB2 |
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-2010079413-A2 | DIPEPTIDYL PEPTIDASE IV INHIBITORS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2010-07-15 | — | — | WO | disclosed |