Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9506686 | 0.79 | CYP2C19 (0.42) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL9506685 | 0.79 | CYP2C19 (0.42) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL17391160 | 0.77 | KDM4E (0.49) | ALDH1A1CYP3A4HPGDMAOAHSD17B10 | |
| SCHEMBL20457805 | 0.69 | KDM4E (0.39) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL183071 | 0.68 | ALDH2 (0.52) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL30028309 | 0.68 | ALDH2 (0.52) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL9072996 | 0.65 | CYP2C19 (0.43) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL14619932 | 0.65 | CYP2C19 (0.43) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL13028651 | 0.65 | CYP2C19 (0.51) | CYP2C19ALDH1A1CYP3A4HPGDMAOA | |
| SCHEMBL6013143 | 0.65 | AHR (0.46) | CYP2C19ALDH1A1CYP3A4HPGDMAOA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1156803-A4 | LACTAM INHIBITORS OF FXa AND METHOD | BRISTOL MYERS SQUIBB CO (US) | 2004-03-17 | — | — | EP | disclosed |
| EP-1156803-A1 | LACTAM INHIBITORS OF FXa AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-11-28 | — | — | EP | disclosed |
| US-6297233-B1 | Lactam inhibitors of FXa and method | BRISTOL-MYERS SQUIBB COMPANY | 2001-10-02 | — | — | US | disclosed |
| WO-2000047207-A1 | LACTAM INHIBITORS OF FXa AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-08-17 | — | — | WO | disclosed |