Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
| ▸ | HRH1 | P35367 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1999955 | 0.93 | SLC6A2 (0.40) | KDM4EALDH1A1HPGDHSD17B10SLC6A2 | |
| SCHEMBL23358779 | 0.83 | CHRM3 (0.41) | KDM4EALDH1A1HPGDHSD17B10CYP19A1 | |
| SCHEMBL4186784 | 0.81 | NAAA (0.39) | KDM4EALDH1A1HPGDHSD17B10SLC6A2 | |
| SCHEMBL1707214 | 0.80 | CHRM3 (0.42) | KDM4EALDH1A1HPGDHSD17B10SLC6A4 | |
| SCHEMBL5473748 | 0.80 | CHRM3 (0.42) | KDM4EALDH1A1HPGDHSD17B10SLC6A4 | |
| SCHEMBL2340421 | 0.80 | CHRM3 (0.42) | KDM4EALDH1A1HPGDHSD17B10SLC6A4 | |
| SCHEMBL1697177 | 0.79 | CHRM4 (0.44) | ALDH1A1CYP2D6CHRM3 | |
| SCHEMBL4889902 | 0.79 | ALDH1A1 (0.34) | KDM4EALDH1A1HPGDHSD17B10CYP19A1 | |
| SCHEMBL7142072 | 0.79 | CHRM3 (0.42) | KDM4EALDH1A1HPGDHSD17B10SLC6A4 | |
| Bromide SCHEMBL1996228 | 0.79 | CHRM3 (0.43) | KDM4EALDH1A1HPGDHSD17B10SLC6A4 |
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-2018150347-A1 | COMPOUNDS WITH BETA-ADRENERGIC AGONIST AND ANTIMUSCARINIC ACTIVITY | TORRENT PHARMACEUTICALS LIMITED (IN) | 2018-08-23 | — | — | WO | disclosed |