Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 10/20 | 0.56 |
| ▸ | DRD2 | P14416 | 7/20 | 0.56 |
| ▸ | DRD4 | P21917 | 6/20 | 0.56 |
| ▸ | HTR1A | P08908 | 3/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | FAAH | O00519 | 3/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7055581 | 0.88 | HTR1A (0.53) | DRD3DRD2DRD4HTR1A | |
| SCHEMBL7056834 | 0.88 | HTR1A (0.56) | DRD3DRD2HTR1A | |
| SCHEMBL7057457 | 0.84 | DRD3 (0.54) | DRD3DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL30080722 | 0.83 | HTR1A (0.77) | DRD3DRD2HTR1A | |
| SCHEMBL946736 | 0.83 | HTR1A (0.77) | DRD3DRD2HTR1A | |
| SCHEMBL30080718 | 0.83 | HTR1A (0.77) | DRD3DRD2HTR1A | |
| SCHEMBL3195928 | 0.83 | HTR1A (0.61) | DRD3DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL7058033 | 0.83 | DRD3 (0.55) | DRD3DRD2DRD4HTR1AKCNH2 | |
| Hydrochloric Acid SCHEMBL3196123 | 0.82 | HTR1A (0.75) | DRD3DRD2HTR1A | |
| SCHEMBL9527924 | 0.82 | HTR1A (0.75) | DRD3DRD2HTR1A |
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-2003028728-A1 | 4-(4-SUBSTITUTED PIPERAZINYL-1YL)-BUTYLCARBOXAMIDES AS D3 DOPAMINE SUBTYPE SELECTIVE LIGANDS | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 2003-04-10 | — | — | WO | disclosed |