Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 8/20 | 0.64 |
| ▸ | HTR1A | P08908 | 8/20 | 0.64 |
| ▸ | HTR7 | P34969 | 4/20 | 0.64 |
| ▸ | HTR2A | P28223 | 3/20 | 0.64 |
| ▸ | HTR6 | P50406 | 3/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.63 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.63 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | GLA | P06280 | 1/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | DRD3 | P35462 | 5/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL7056493 | 0.89 | HTR1A (0.76) | DRD2HTR1AHTR7HTR2AHTR6 | |
| SCHEMBL7058203 | 0.84 | HTR1A (0.60) | DRD2HTR1AHTR7ALDH1A1ADRA1D | |
| SCHEMBL7056520 | 0.81 | DRD2 (0.66) | DRD2HTR1AHTR7HTR2AHTR6 | |
| SCHEMBL7057971 | 0.81 | DRD2 (0.45) | DRD2HTR1AHTR7HTR2AHTR6 | |
| SCHEMBL5174948 | 0.78 | HTR1A (0.68) | DRD2HTR1AHTR7HTR2AHTR6 | |
| Nan-190 SCHEMBL30080779 | 0.78 | HTR1A (1.00) | DRD2HTR1AHTR7HTR2AHTR6 | |
| Nan-190 SCHEMBL2231820 | 0.78 | HTR1A (1.00) | DRD2HTR1AHTR7HTR2AHTR6 | |
| Nan-190 SCHEMBL29389115 | 0.78 | HTR1A (1.00) | DRD2HTR1AHTR7HTR2AHTR6 | |
| SCHEMBL4902771 | 0.78 | HTR1A (0.77) | DRD2HTR1AHTR7HTR2AHTR6 | |
| Nan-190 SCHEMBL29390376 | 0.77 | ALDH1A1 (1.00) | DRD2HTR1AHTR7HTR2AHTR6 |
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 |