Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 9/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 2/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.39 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 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 | |
|---|---|---|---|---|
| SCHEMBL1196352 | 0.80 | ACE (0.48) | ITGB3ITGA2BALDH1A1CYP3A4HPGD | |
| SCHEMBL1196353 | 0.80 | ACE (0.48) | ITGB3ITGA2BALDH1A1CYP3A4HPGD | |
| SCHEMBL5500074 | 0.78 | CPB2 (0.47) | ITGB3ITGA2BACEACE2CPB2 | |
| SCHEMBL7300962 | 0.78 | ITGB3 (0.41) | ITGB3ITGA2BACEACE2ITGB1 | |
| SCHEMBL7300949 | 0.78 | ITGB3 (0.41) | ITGB3ITGA2BACEACE2ITGB1 | |
| SCHEMBL4759546 | 0.75 | SMN1; SMN2 (0.37) | ALDH1A1HPGDMAPK1TSHRL3MBTL1 | |
| SCHEMBL3663113 | 0.74 | CTSK (0.47) | ITGB3ITGA2BACEACE2ITGB1 | |
| SCHEMBL5086307 | 0.74 | HDAC6 (0.49) | ITGB3ITGA2BHPGDACEACE2 | |
| SCHEMBL10477488 | 0.74 | ITGB1 (0.43) | ITGB3ITGA2BHPGDITGB1ITGA4 | |
| SCHEMBL6015436 | 0.74 | ITGB1 (0.43) | ITGB3ITGA2BHPGDITGB1ITGA4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1981854-A1 | ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS | Brystol-Myers Squibb Company (US) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007070826-A1 | ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-06-21 | — | — | WO | disclosed |