Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 18/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.50 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.50 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11470080 | 0.92 | SLC6A2 (0.43) | SLC6A2SLC6A4CYP3A4SLC22A2SLC22A1 | |
| SCHEMBL11483819 | 0.83 | ALDH1A1 (0.41) | CHRM2CHRM1DRD2CHRM3DRD3 | |
| SCHEMBL11474941 | 0.82 | SLC6A4 (0.50) | SLC6A2SLC6A4CYP3A4SLC22A2SLC22A1 | |
| Hydrochloric Acid SCHEMBL11475198 | 0.81 | LMNA (0.51) | SLC6A2SLC6A4CYP3A4SLC22A2SLC22A1 | |
| SCHEMBL11469188 | 0.80 | ALDH1A1 (0.42) | CYP3A4DRD2DRD3MEN1KMT2A | |
| SCHEMBL11472520 | 0.78 | HRH3 (0.34) | CYP2D6DRD2DRD3HTTCACNA1B | |
| SCHEMBL11472872 | 0.76 | SLC6A2 (0.46) | SLC6A2SLC6A4CYP3A4SLC22A2SLC22A1 | |
| SCHEMBL11470759 | 0.75 | ALDH1A1 (0.35) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| Mezepine SCHEMBL38660320 | 0.74 | SLC6A2 (0.55) | SLC6A2SLC6A4CYP3A4SLC22A2SLC22A1 | |
| Mezepine SCHEMBL2110147 | 0.74 | SLC6A2 (0.55) | SLC6A2SLC6A4CYP3A4SLC22A2SLC22A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4192874-A | Substituted 1,2,6,7-tetrahydroindolo[1,7-ab][1,5]benzodiazepines | AMERICAN HOECHST CORPORATION (US) | 1980-03-11 | — | — | US | claimed |