Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD4 | P21917 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HTR7 | P34969 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5026258 | 0.71 | DRD2 (0.54) | DRD2DRD4HTR2AHTR7DRD3 | |
| SCHEMBL10431044 | 0.71 | ACHE (0.50) | LMNANPSR1 | |
| SCHEMBL7327983 | 0.71 | DRD2 (0.56) | DRD2DRD4HTR2AHTR7DRD3 | |
| SCHEMBL28159149 | 0.69 | CYP1A2 (0.51) | DRD2HTR2AHTR7DRD3ALDH1A1 | |
| SCHEMBL28159148 | 0.69 | POLB (0.54) | ALDH1A1HPGDNPC1MAPTRAB9A | |
| SCHEMBL10989220 | 0.68 | CYP1A2 (0.67) | DRD2HTR2AHTR7DRD3ALDH1A1 | |
| SCHEMBL9560694 | 0.68 | LTA4H (0.43) | ALDH1A1NPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL7414312 | 0.66 | PSEN1 (0.41) | — | |
| SCHEMBL29023739 | 0.66 | APEX1 (0.61) | DRD2HTR2AHTR7DRD3ALDH1A1 | |
| SCHEMBL27777618 | 0.66 | ALDH1A1 (0.56) | ALDH1A1HPGDNPC1MAPTRAB9A |
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-2008133884-A2 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | COMBINATORX, INCORPORATED (US) | 2008-11-06 | — | — | WO | disclosed |