Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.49 |
| ▸ | HPGD | P15428 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.49 |
| ▸ | GLA | P06280 | 3/20 | 0.49 |
| ▸ | CASP1 | P29466 | 3/20 | 0.49 |
| ▸ | CASP7 | P55210 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.47 |
| ▸ | ALDH1A2 | O94788 | 3/20 | 0.46 |
| ▸ | ALDH2 | P05091 | 3/20 | 0.46 |
| ▸ | ALDH1B1 | P30837 | 3/20 | 0.46 |
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7798964 | 0.81 | KDM4E (0.74) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8374891 | 0.80 | HSD17B3 (0.61) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL7797760 | 0.80 | KDM4E (0.71) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL6487039 | 0.77 | KDM4E (0.65) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL6478947 | 0.76 | KDM4E (0.61) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL14930178 | 0.73 | KDM4E (0.50) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL14925307 | 0.73 | KDM4E (0.71) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL27617272 | 0.73 | HSD17B3 (0.61) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL14930185 | 0.72 | MAOB (0.47) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL14925284 | 0.72 | NQO1 (0.47) | ALDH1A1KDM4EHPGDHSD17B10GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1199963-C | Coumarin derivatives with COMT inhibiting activity | ORION CORP (FI) | 2005-05-04 | — | — | CN | disclosed |
| CN-1440399-A | Coumarin derivatives with COMT inhibiting activity | ORION CORP (FI) | 2003-09-03 | — | — | CN | disclosed |