Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.56 |
| ▸ | SERPINE1 | P05121 | 4/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | XDH | P47989 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10728223 | 0.85 | CA12 (0.68) | L3MBTL1KDM4EPOLBGAAXDH | |
| SCHEMBL18328175 | 0.84 | TSHR (0.57) | L3MBTL1LMNAPOLBTDP1HCAR2 | |
| SCHEMBL28159387 | 0.84 | TSHR (0.57) | L3MBTL1LMNAPOLBTDP1HCAR2 | |
| SCHEMBL213819 | 0.84 | TSHR (0.57) | L3MBTL1LMNAPOLBTDP1HCAR2 | |
| SCHEMBL28202615 | 0.82 | TSHR (0.55) | LMNAPOLBHCAR2ALDH1A1TP53 | |
| SCHEMBL4735872 | 0.81 | HKDC1 (0.54) | NSD2SERPINE1L3MBTL1KDM4ELMNA | |
| SCHEMBL3628983 | 0.81 | ESR1 (0.70) | LMNAPOLBHCAR2ALDH1A1TP53 | |
| SCHEMBL9374297 | 0.80 | HCAR2 (0.45) | KDM4EHCAR2ALDH1A1TP53HSD17B10 | |
| SCHEMBL8956795 | 0.79 | PDCD1 (0.69) | LMNAPOLBHCAR2ALDH1A1TP53 | |
| SCHEMBL4733680 | 0.78 | SERPINE1 (0.56) | NSD2SERPINE1L3MBTL1HKDC1ESR1 |
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-2008065527-A2 | GALLIC ACID ESTERS OF FRAGRANT ALCOHOLS | GHISALBERTI CARLO (BR) | 2008-06-05 | — | — | WO | disclosed |