Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6657574 | 1.00 | TDP1 (0.52) | TDP1ALDH1A1MAPTKDM4ERAB9A | |
| SCHEMBL7933746 | 0.84 | RAB9A (0.66) | ALDH1A1RAB9AMAPK1HSD17B10PDE4A | |
| SCHEMBL6661088 | 0.84 | RAB9A (0.66) | ALDH1A1RAB9AMAPK1HSD17B10PDE4A | |
| SCHEMBL1928738 | 0.84 | SMN1; SMN2 (0.59) | ALDH1A1MAPTKDM4ERAB9AMAPK1 | |
| SCHEMBL14691237 | 0.84 | SMN1; SMN2 (0.59) | ALDH1A1MAPTKDM4ERAB9AMAPK1 | |
| SCHEMBL7931260 | 0.84 | RAB9A (0.45) | ALDH1A1MAPTKDM4ERAB9AMAPK1 | |
| SCHEMBL7931264 | 0.84 | RAB9A (0.45) | ALDH1A1MAPTKDM4ERAB9AMAPK1 | |
| SCHEMBL6661082 | 0.84 | RAB9A (0.66) | ALDH1A1RAB9AMAPK1HSD17B10PDE4A | |
| SCHEMBL2649166 | 0.84 | SMN1; SMN2 (0.59) | ALDH1A1MAPTKDM4ERAB9AMAPK1 | |
| SCHEMBL7921709 | 0.83 | TSHR (0.50) | TDP1ALDH1A1MAPTKDM4ERAB9A |
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-2004011414-A1 | E-ISOMERIC β-AROMATIC OR HETEROAROMATIC SUBSTITUTED β-ACYLAMINO-ACRYLATES AND METHODS OF PREPARING THE SAME | DSM IP ASSETS B.V. (NL) | 2004-02-05 | — | — | WO | disclosed |