Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | ALPG | P10696 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7962214 | 0.84 | ALDH1A1 (0.46) | ALDH1A1ADORA2BL3MBTL1HPGDHSD17B10 | |
| SCHEMBL7950863 | 0.82 | ALDH1A1 (0.42) | ALDH1A1ADORA2BL3MBTL1HPGDHSD17B10 | |
| SCHEMBL7293146 | 0.81 | ALDH1A1 (0.48) | ALDH1A1ADORA2BL3MBTL1HPGDHSD17B10 | |
| SCHEMBL7965028 | 0.81 | ALDH1A1 (0.47) | ALDH1A1ADORA2BL3MBTL1HPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL7962958 | 0.80 | ALDH1A1 (0.46) | ALDH1A1ADORA2BL3MBTL1HPGDHSD17B10 | |
| SCHEMBL7474776 | 0.76 | ALDH1A1 (0.46) | ALDH1A1ADORA2BL3MBTL1HPGDHSD17B10 | |
| SCHEMBL7959205 | 0.76 | ALDH1A1 (0.49) | ALDH1A1ADORA2BL3MBTL1HPGDKDM4E | |
| SCHEMBL7293735 | 0.75 | KDM4E (0.54) | ALDH1A1L3MBTL1HPGDHSD17B10KDM4E | |
| SCHEMBL27556833 | 0.73 | COMT (0.36) | ALDH1A1L3MBTL1HPGDKDM4ECYP1A2 | |
| SCHEMBL7965013 | 0.72 | HSD17B10 (0.37) | ALDH1A1ADORA2BHPGDHSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6300337-B1 | Acetamide derivative and use thereof | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2001-10-09 | — | — | US | disclosed |
| EP-1055683-A1 | NOVEL ACETAMIDE DERIVATIVE AND USE THEREOF | Nippon Kayaku Kabushiki Kaisha (JP) | 2000-11-29 | — | — | EP | disclosed |