Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.46 |
| ▸ | HTR2A | P28223 | 4/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.46 |
| ▸ | HRH1 | P35367 | 4/20 | 0.46 |
| ▸ | DRD3 | P35462 | 4/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | DRD4 | P21917 | 3/20 | 0.46 |
| ▸ | DRD5 | P21918 | 3/20 | 0.46 |
| ▸ | HRH2 | P25021 | 3/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.46 |
| ▸ | HTR7 | P34969 | 3/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.46 |
| ▸ | HTR6 | P50406 | 3/20 | 0.46 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.46 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL931297 | 0.85 | ESR1 (0.42) | SLC6A3ADORA3ADRA1ADRD3OPRM1 | |
| SCHEMBL5687856 | 0.82 | HDAC4 (0.41) | CYP2D6MAPK1MEN1KMT2ACYP2C9 | |
| SCHEMBL24333940 | 0.80 | LMNA (0.43) | CYP3A4CYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL830770 | 0.75 | ALDH1A1 (0.43) | SLC6A3ADORA3ADRA1ADRD3OPRM1 | |
| SCHEMBL3801810 | 0.75 | TNKS2 (0.48) | RAB9ASMN1; SMN2ALDH1A1LMNAHPGD | |
| SCHEMBL13034072 | 0.75 | POLB (0.55) | DRD3DRD4DRD2FAAHMEN1 | |
| SCHEMBL7002076 | 0.74 | TSHR (0.44) | SLC6A3ADORA3HTR2AADRA1AHRH1 | |
| SCHEMBL27777636 | 0.74 | ALDH1A1 (0.43) | CYP3A4CYP2D6RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL3980676 | 0.74 | MTNR1A (0.53) | CYP3A4CYP2D6KMT2AEPHX2ALDH1A1 | |
| SCHEMBL8109949 | 0.74 | CACNA1B (0.50) | SLC6A3ADORA3HTR2AADRA1AHRH1 |
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-1042275-B1 | ANTICONVULSANT AND CENTRAL NERVOUS SYSTEM-ACTIVE BIS(FLUOROPHENYL)ALKYLAMIDES | NPS PHARMA INC (US) | 2005-11-09 | — | — | EP | disclosed |