Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.62 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | BCL9 | O00512 | 1/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9352637 | 0.94 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL904579 | 0.83 | TDP1 (0.55) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL28078511 | 0.81 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL27811011 | 0.80 | SLC6A2 (0.54) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL28003628 | 0.80 | TDP1 (0.50) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL28179085 | 0.79 | MAPK1 (0.56) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL28673114 | 0.79 | MAPT (0.64) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL24421736 | 0.78 | MAPK1 (0.55) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B | |
| SCHEMBL4938101 | 0.77 | SLC6A3 (1.00) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4875245 | 0.77 | MAPK1 (0.62) | SLC6A2SLC6A4SLC6A3MAPK1GSK3B |
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-0312895-A2 | Condensed diazepinones, process for their preparation and medicament containing them | Dr. Karl Thomae GmbH (DE) | 1989-04-26 | — | — | EP | disclosed |