Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 5/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10695453 | 0.77 | KCNH2 (0.52) | HRH3SLC18A3KCNH2CCR5L3MBTL1 | |
| SCHEMBL10964456 | 0.73 | SLC6A2 (0.54) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL10964462 | 0.73 | SLC6A2 (0.54) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL11105295 | 0.73 | SLC6A2 (0.54) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL11105288 | 0.73 | SLC6A2 (0.54) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL10964465 | 0.73 | SLC6A2 (0.54) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL10057687 | 0.73 | SLC18A3 (0.57) | HTTKDM1AHRH3SLC18A3KCNH2 | |
| Hydrochloric Acid SCHEMBL11581293 | 0.72 | SLC6A2 (0.52) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL11581300 | 0.72 | SLC6A2 (0.52) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL11581289 | 0.72 | SLC6A2 (0.52) | KDM1ASLC18A3SLC6A4SLC6A3SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0252482-A2 | 7-Acyloxy-6-aminoacyloxypolyoxylabdanes, process for their preparation and their use as medicine | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-01-13 | — | — | EP | disclosed |