Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.66 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29458789 | 0.85 | ACHE (0.61) | ALDH1A1ACHEMAOBCA1CA2 | |
| SCHEMBL4547729 | 0.85 | ALDH1A1 (0.52) | ALDH1A1CYP2A6DRD1 | |
| SCHEMBL1470672 | 0.85 | ACHE (0.61) | ALDH1A1ACHEMAOBCA1CA2 | |
| SCHEMBL6351 | 0.83 | ALDH1A1 (0.86) | ALDH1A1CYP2A6TRPA1CA1CA2 | |
| SCHEMBL19214399 | 0.83 | ALDH1A1 (0.86) | ALDH1A1CYP2A6TRPA1CA1CA2 | |
| SCHEMBL4309836 | 0.83 | ACHE (0.54) | ALDH1A1ACHETRPA1MAOBCA1 | |
| SCHEMBL13499831 | 0.82 | ALDH1A1 (0.51) | ALDH1A1CYP2A6TRPA1KMT2AMEN1 | |
| Biphenyl SCHEMBL10800283 | 0.82 | ALDH1A1 (0.76) | ALDH1A1CYP2A6TRPA1KMT2AMEN1 | |
| Anisaldehyde SCHEMBL20357563 | 0.81 | ALDH1A1 (0.83) | ALDH1A1CYP2A6TRPA1KMT2AMEN1 | |
| SCHEMBL21235656 | 0.81 | ACHE (0.62) | ALDH1A1ACHETDP1MAOBCA1 |
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-2004092185-A1 | LUMINESCENT LANTHANIDE (III) -CHELATED DENDRITIC COMPLEXES HAVING LIGHT-HARVESTING EFFECT AND THEIR SYNTHETIC METHODS | KIM HWAN-KYU (KR) | 2004-10-28 | — | — | WO | disclosed |