Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | DAO | P14920 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | DRD1 | P21728 | 9/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL3310259 | 0.82 | ALDH1A1 (0.37) | ALDH1A1DAOHPGDDRD1MAPK1 | |
| SCHEMBL4752664 | 0.82 | ALDH1A1 (0.37) | ALDH1A1DAOHPGDDRD1MAPK1 | |
| SCHEMBL3304805 | 0.78 | ALDH1A1 (0.41) | ALDH1A1DAOHPGDDRD1MAPK1 | |
| SCHEMBL4748999 | 0.77 | DRD1 (0.35) | DRD1MAPK1THPOHIF1AHSD17B10 | |
| SCHEMBL13473825 | 0.76 | LOX (0.40) | ALDH1A1KMT2A | |
| SCHEMBL3309101 | 0.75 | ALDH1A1 (0.64) | ALDH1A1DAOHPGDMAPK1KDM4E | |
| SCHEMBL3307455 | 0.73 | HPGD (0.40) | ALDH1A1HPGDMAPK1HSD17B10KDM4E | |
| SCHEMBL3313449 | 0.73 | ALDH1A1 (0.56) | ALDH1A1DAOHPGDKDM4EMAPT | |
| SCHEMBL12886566 | 0.70 | KDM4E (0.30) | ALDH1A1HPGDKDM4E | |
| SCHEMBL2761887 | 0.70 | ALDH1A1 (0.56) | ALDH1A1DAOHPGDKDM4EMAPT |
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-2008135526-A1 | CARBOXYLIC ACID AMIDES AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-11-13 | — | — | WO | disclosed |