Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 3/20 | 0.40 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8150375 | 0.88 | DGAT1 (0.42) | NNMTSIRT3TDP1DGAT1KDM4E | |
| SCHEMBL8155379 | 0.88 | POLB (0.38) | NNMTPOLBKDM4EALDH1A1GLA | |
| SCHEMBL8147755 | 0.88 | DGAT1 (0.42) | NNMTSIRT3TDP1DGAT1KDM4E | |
| SCHEMBL8149546 | 0.88 | POLB (0.38) | NNMTPOLBKDM4EALDH1A1GLA | |
| SCHEMBL8155359 | 0.82 | DGAT1 (0.47) | DGAT1POLBKDM4EL3MBTL1IRAK4 | |
| SCHEMBL8150190 | 0.82 | DGAT1 (0.47) | DGAT1POLBKDM4EL3MBTL1IRAK4 | |
| SCHEMBL8154386 | 0.80 | PRSS1 (0.39) | — | |
| SCHEMBL8147743 | 0.80 | POLB (0.43) | NNMTSIRT3TDP1POLBKDM4E | |
| SCHEMBL8154315 | 0.80 | DGAT1 (0.40) | NNMTSIRT3TDP1DGAT1POLB | |
| SCHEMBL20519345 | 0.79 | NNMT (0.42) | NNMTSIRT3TDP1DGAT1MKNK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20040116399-A1 | Inhibitors of factor Xa | MILLENNIUM PHARMACEUTICALS, INC. | 2004-06-17 | — | — | US | disclosed |
| US-20040116399-A1 | Inhibitors of factor Xa | MILLENNIUM PHARMACEUTICALS, INC. | 2004-06-17 | — | — | US | disclosed |