Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 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 | |
|---|---|---|---|---|
| SCHEMBL7835081 | 1.00 | HTR1A (0.42) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL7847827 | 0.94 | HTR1A (0.44) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL7847830 | 0.94 | HTR1A (0.44) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL7837349 | 0.93 | HTR1A (0.44) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL7837347 | 0.93 | HTR1A (0.44) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL8314819 | 0.90 | NPC1 (0.45) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL8382965 | 0.89 | DRD2 (0.42) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL8382326 | 0.89 | DRD2 (0.42) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL8386702 | 0.88 | HTR1A (0.45) | HTR1ADRD2DRD3NPC1MTOR | |
| SCHEMBL8384036 | 0.88 | HTR1A (0.45) | HTR1ADRD2DRD3NPC1MTOR |
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-0942911-B1 | BENZOPYRANOPYRROLE AND BENZOPYRANOPYRIDINE ALPHA-1 ADRENERGIC COMPOUNDS | ABBOTT LAB (US) | 2001-10-17 | — | — | EP | disclosed |