Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PTPRA | P18433 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.38 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1858714 | 0.85 | TSHR (0.57) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL29520732 | 0.85 | TSHR (0.57) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL27813115 | 0.79 | SLC6A2 (0.48) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL27946805 | 0.79 | SLC6A2 (0.48) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| Carbamic Acid SCHEMBL8397235 | 0.79 | CYP1A2 (0.47) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL24126990 | 0.78 | TSHR (0.55) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL27833164 | 0.78 | SLC6A2 (0.47) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL11029621 | 0.76 | CYP1A2 (0.46) | TSHRKDM4EPTPRACYP1A2ALDH1A1 | |
| SCHEMBL7035596 | 0.74 | SLC6A2 (0.47) | TSHRSLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL30321061 | 0.74 | SLC6A2 (0.50) | TSHRSLC6A2SLC6A4SLC6A3KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2391606-A1 | ETHANAMINE COMPOUNDS AND THEIR USE FOR TREATING DEPRESSION | AstraZeneca AB (SE) | 2011-12-07 | — | — | EP | disclosed |
| WO-2010074647-A1 | ETHANAMINE COMPOUNDS AND THEIR USE FOR TREATING DEPRESSION | ASTRAZENECA AB (SE) | 2010-07-01 | — | — | WO | disclosed |