Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 6/20 | 0.50 |
| ▸ | MAOA | P21397 | 5/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10012545 | 0.82 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL14008049 | 0.81 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL14008050 | 0.81 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL19658356 | 0.81 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL31171940 | 0.79 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL10871767 | 0.78 | SLC6A2 (0.62) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL14323263 | 0.78 | SLC6A2 (0.62) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL19285766 | 0.77 | MAOB (0.69) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL3730598 | 0.76 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C | |
| SCHEMBL13623693 | 0.74 | MAOB (0.65) | SLC6A2SLC6A4SLC6A3ADRA2BADRA2C |
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-0109023-A1 | Isoquinolinesulfonamide derivatives and process for the preparation thereof | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1984-05-23 | — | — | EP | disclosed |