Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.78 |
| ▸ | HPGD | P15428 | 5/20 | 0.78 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.78 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.78 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.74 |
| ▸ | ACHE | P22303 | 3/20 | 0.67 |
| ▸ | NPC1 | O15118 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 4/20 | 0.62 |
| ▸ | MAOA | P21397 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.53 |
| ▸ | MGAM | O43451 | 1/20 | 0.49 |
| ▸ | SI | P14410 | 1/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.49 |
| ▸ | GAPDH | P04406 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Marmesin Acetate SCHEMBL12062110 | 0.88 | ALDH1A1 (1.00) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Marmesin Acetate SCHEMBL2257271 | 0.88 | ALDH1A1 (1.00) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Felamidin SCHEMBL30467160 | 0.81 | ALDH1A1 (0.75) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Felamidin SCHEMBL12062114 | 0.81 | ALDH1A1 (0.75) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Marmesin SCHEMBL29471037 | 0.81 | ACHE (1.00) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Marmesin SCHEMBL12062107 | 0.81 | ACHE (1.00) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Marmesin SCHEMBL30977125 | 0.81 | ACHE (1.00) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| Marmesin SCHEMBL546574 | 0.81 | ACHE (1.00) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL14105336 | 0.79 | MAOA (0.64) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL30777266 | 0.79 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 |
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-2010064817-A2 | NOVEL COUMARIN-BASED COMPOUNDS, PREPARATION METHOD THEREOF, AND MULTIDRUG RESISTANCE INHIBITORY PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AS ACTIVE INGREDIENTS | 한국생명공학연구원 (KR) | 2010-06-10 | — | — | WO | disclosed |