Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | EBP | Q15125 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6640607 | 0.77 | MEN1 (0.42) | KMT2AMEN1TP53CYP3A4CYP2D6 | |
| SCHEMBL6643605 | 0.76 | MEN1 (0.41) | KMT2AMEN1TP53CYP3A4CYP2D6 | |
| SCHEMBL6636865 | 0.74 | MEN1 (0.43) | KMT2AMEN1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27678126 | 0.73 | KMT2A (0.37) | KMT2AMEN1TP53CYP3A4CYP2D6 | |
| SCHEMBL6322319 | 0.72 | MEN1 (0.37) | KMT2AMEN1TP53CYP3A4CYP2D6 | |
| SCHEMBL6321221 | 0.72 | GPR39 (0.42) | KMT2AMEN1TP53CYP3A4CYP2D6 | |
| SCHEMBL6640137 | 0.71 | KMT2A (0.43) | KMT2AMEN1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6320544 | 0.70 | CYP2D6 (0.35) | KMT2AMEN1TP53CYP3A4CYP2D6 | |
| SCHEMBL6322714 | 0.69 | KDM4E (0.38) | KDM4EALDH1A1HTTCD274PKM | |
| SCHEMBL6325686 | 0.69 | PIM1 (0.41) | CYP2D6CYP2C9CYP2C19CXCR4 |
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-1140941-B1 | NITROGEN CONTAINING HETEROBICYCLES AS FACTOR XA INHIBITORS | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2004-10-20 | — | — | EP | disclosed |
| EP-1140941-A1 | NITROGEN CONTAINING HETEROBICYCLES AS FACTOR XA INHIBITORS | Du Pont Pharmaceuticals Company (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000039131-A1 | NITROGEN CONTAINING HETEROBICYCLES AS FACTOR XA INHIBITORS | DU PONT PHARMACEUTICALS COMPANY (US) | 2000-07-06 | — | — | WO | disclosed |