Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | KMO | O15229 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.34 |
| ▸ | WNT3A | P56704 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 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 | |
|---|---|---|---|---|
| SCHEMBL10404615 | 0.81 | ALDH1A1 (0.41) | ALDH1A1MAPTSMN1; SMN2DAOTDP1 | |
| SCHEMBL2179646 | 0.76 | ALDH1A1 (0.48) | ALDH1A1MAPTSMN1; SMN2TDP1MEN1 | |
| SCHEMBL10404311 | 0.73 | DAO (0.34) | ALDH1A1MAPTSMN1; SMN2DAOTDP1 | |
| SCHEMBL12405041 | 0.72 | ALDH1A1 (0.45) | ALDH1A1MAPTSMN1; SMN2TDP1MEN1 | |
| SCHEMBL17234682 | 0.72 | DYRK1A (0.38) | ALDH1A1MAPTSMN1; SMN2TDP1MEN1 | |
| SCHEMBL30370935 | 0.72 | DYRK1A (0.38) | ALDH1A1MAPTSMN1; SMN2TDP1MEN1 | |
| SCHEMBL31518690 | 0.71 | ALDH1A1 (0.43) | ALDH1A1MAPTSMN1; SMN2DAOTDP1 | |
| SCHEMBL2329568 | 0.70 | ALDH1A1 (0.59) | ALDH1A1MAPTSMN1; SMN2TDP1MEN1 | |
| SCHEMBL10402795 | 0.70 | TSHR (0.45) | ALDH1A1MAPTSMN1; SMN2MEN1KMT2A | |
| SCHEMBL10651674 | 0.68 | MGAM (0.48) | ALDH1A1MAPTDAOTDP1MEN1 |
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-2011073316-A1 | 4-ARYL-BUTANE-1,3-DIAMIDES | NOVARTIS AG (CH) | 2011-06-23 | — | — | WO | disclosed |