Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | PLAT | P00750 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | SELL | P14151 | 1/20 | 0.32 |
| ▸ | SELP | P16109 | 1/20 | 0.32 |
| ▸ | SELE | P16581 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4776743 | 0.85 | CYP2C19 (0.42) | CYP2C19ALDH1A1LMNAPLGPLAT | |
| SCHEMBL443194 | 0.82 | GAA (0.37) | CYP2C19ALDH1A1GAACYP1A2CYP2D6 | |
| SCHEMBL443195 | 0.82 | GAA (0.37) | CYP2C19ALDH1A1GAACYP1A2CYP2D6 | |
| SCHEMBL316549 | 0.81 | KDM4E (0.37) | CYP2C19ALDH1A1LMNAGAACYP2C9 | |
| SCHEMBL8284375 | 0.72 | KMT2A (0.55) | HPGDKMT2A | |
| SCHEMBL17144525 | 0.71 | HSD17B10 (0.39) | CYP2C19ALDH1A1LMNAGAAHPGD | |
| SCHEMBL14303404 | 0.69 | ALDH1A1 (0.54) | CYP2C19ALDH1A1GAAHPGDSMN1; SMN2 | |
| SCHEMBL19828775 | 0.69 | CYP2C19 (0.42) | CYP2C19ALDH1A1GAAHPGDCYP1A2 | |
| SCHEMBL4781436 | 0.68 | GAA (0.36) | CYP2C19ALDH1A1LMNAPLGPLAT | |
| SCHEMBL9933948 | 0.68 | — | — |
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-2008011130-A2 | AMIDE COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-01-24 | — | — | WO | disclosed |