Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 6/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7049344 | 0.90 | JAK2 (0.39) | ALDH1A1EPHX2DRD2AAK1ENPP2 | |
| SCHEMBL7045257 | 0.84 | DPP4 (0.37) | AAK1JAK3BTK | |
| SCHEMBL7045772 | 0.81 | JAK2 (0.40) | ALDH1A1EPHX2ENPP2JAK3 | |
| SCHEMBL7045869 | 0.80 | NAMPT (0.40) | EGLN1JAK3BTK | |
| SCHEMBL8781179 | 0.76 | DPP4 (0.37) | AAK1 | |
| SCHEMBL7046882 | 0.75 | JAK2 (0.39) | ALDH1A1EPHX2DRD2AAK1ENPP2 | |
| SCHEMBL5900915 | 0.75 | MEN1 (0.44) | ALDH1A1DRD2BTK | |
| SCHEMBL13780330 | 0.75 | P2RX7 (0.53) | P2RX7ALDH1A1EPHX2 | |
| SCHEMBL5900918 | 0.72 | MEN1 (0.45) | ALDH1A1DRD2BTK | |
| SCHEMBL7048588 | 0.71 | NAMPT (0.39) | EGLN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0773955-B1 | NEW THROMBIN INHIBITORS, THEIR PREPARATION AND USE | BASF AG (DE) | 2003-04-16 | — | — | EP | disclosed |
| EP-0773955-A1 | NEW THROMBIN INHIBITORS, THEIR PREPARATION AND USE | BASF AKTIENGESELLSCHAFT (DE) | 1997-05-21 | — | — | EP | disclosed |
| WO-1995035309-A1 | NEW THROMBIN INHIBITORS, THEIR PREPARATION AND USE | BASF AKTIENGESELLSCHAFT (DE) | 1995-12-28 | — | — | WO | disclosed |