Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.62 |
| ▸ | HTR2C | P28335 | 6/20 | 0.62 |
| ▸ | PNMT | P11086 | 1/20 | 0.45 |
| ▸ | CD44 | P16070 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 3/20 | 0.41 |
| ▸ | KDM1A | O60341 | 3/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| SCHEMBL173319 | 0.83 | HTR2A (0.51) | HTR2AHTR2CPNMTCD44MAOB | |
| Hydrochloric Acid SCHEMBL5317898 | 0.81 | HTR2A (0.50) | HTR2AHTR2CPNMTCD44MAOB | |
| SCHEMBL29588076 | 0.80 | HTR2A (0.42) | HTR2AHTR2CPNMTCD44MAOB | |
| SCHEMBL329676 | 0.80 | HTR2A (0.42) | HTR2AHTR2CPNMTCD44MAOB | |
| SCHEMBL24716933 | 0.79 | HTR2A (0.47) | HTR2AHTR2CPNMTCD44MAOB | |
| Hydrochloric Acid SCHEMBL550115 | 0.78 | HTR2C (0.41) | HTR2AHTR2CPNMTCD44MAOB | |
| SCHEMBL6956152 | 0.77 | HTR2A (0.41) | HTR2AHTR2CDRD2SLC6A2SLC6A4 | |
| SCHEMBL2368756 | 0.77 | HTR2A (1.00) | HTR2AHTR2CPNMTSLC6A2SLC6A4 | |
| SCHEMBL6661043 | 0.77 | HTR2A (0.66) | HTR2AHTR2CPNMTHTR2BKDM1A | |
| SCHEMBL29051751 | 0.75 | HTR2A (0.59) | HTR2AHTR2CDRD2DRD1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996004271-A1 | CONDENSED AZEPINE DERIVATIVES, DRUGS CONTAINING THESE COMPOUNDS AND METHODS FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-02-15 | — | — | WO | disclosed |