Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 3/20 | 0.39 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.39 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14242951 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL14243152 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL16233094 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL7614307 | 0.77 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL7616411 | 0.77 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL7583554 | 0.77 | ALDH1A1 (0.44) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL4186655 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL31738417 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL7137868 | 0.74 | ALDH1A1 (0.44) | ALDH1A1KDM4ETDP1TSHRERN1 | |
| SCHEMBL8324591 | 0.74 | ALDH1A1 (0.44) | ALDH1A1KDM4ETDP1TSHRERN1 |
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-2012167364-A1 | PHENOLIC COMPOUNDS WITH ANTIOXIDANT AND ANTI-CANCER PROPERTIES, ANALOGS AND SYNTHESIS THEREOF | FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) | 2012-12-13 | — | — | WO | disclosed |