Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.37 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.37 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13713534 | 0.84 | EPHX2 (0.47) | EPHX1EPHX2ALDH1A1GLANPC1 | |
| SCHEMBL8790490 | 0.83 | SMYD3 (0.48) | ITGB3ITGA2BEPHX1EPHX2ALDH1A1 | |
| SCHEMBL12424637 | 0.79 | NPC1 (0.46) | ITGB3ITGA2BEPHX1EPHX2ALDH1A1 | |
| SCHEMBL23136277 | 0.77 | BRD4 (0.44) | EPHX1EPHX2BRD4 | |
| SCHEMBL2210266 | 0.77 | BRD4 (0.44) | EPHX1EPHX2ALDH1A1BRD4MEN1 | |
| SCHEMBL7359190 | 0.77 | TMEM97 (0.51) | ITGB3ITGA2BALDH1A1NPC1MEN1 | |
| SCHEMBL13712962 | 0.77 | FAAH (0.43) | EPHX1EPHX2ALDH1A1GLABRD4 | |
| SCHEMBL12669611 | 0.76 | BRD4 (0.42) | ITGB3ITGA2BEPHX1EPHX2ALDH1A1 | |
| SCHEMBL14174867 | 0.75 | NPC1 (0.69) | ALDH1A1NPC1MEN1KMT2A | |
| SCHEMBL19502819 | 0.74 | GNAI3 (0.58) | ITGB3ITGA2BALDH1A1NPC1GNAI3 |
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-1996020172-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED β-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | NIPPON STEEL CORPORATION (JP) | 1996-07-04 | — | — | WO | disclosed |