Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 17/20 | 1.00 |
| ▸ | DRD2 | P14416 | 16/20 | 1.00 |
| ▸ | DRD4 | P21917 | 11/20 | 1.00 |
| ▸ | HTR1A | P08908 | 7/20 | 1.00 |
| ▸ | ADRA1D | P25100 | 7/20 | 1.00 |
| ▸ | ADRA1A | P35348 | 7/20 | 1.00 |
| ▸ | ADRA1B | P35368 | 7/20 | 1.00 |
| ▸ | DRD1 | P21728 | 6/20 | 1.00 |
| ▸ | HTR2A | P28223 | 5/20 | 1.00 |
| ▸ | HTR2C | P28335 | 4/20 | 1.00 |
| ▸ | HTR2B | P41595 | 4/20 | 1.00 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL13094475 | 0.85 | DRD3 (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| SCHEMBL9653810 | 0.84 | DRD2 (0.93) | DRD3DRD2DRD4HTR1AADRA1D | |
| SCHEMBL30298994 | 0.83 | DRD3 (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| SCHEMBL9650843 | 0.83 | ADRA1D (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| Bp-897 SCHEMBL2125882 | 0.82 | DRD2 (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| Bp-897 SCHEMBL30027453 | 0.82 | DRD2 (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| Bp-897 SCHEMBL29382551 | 0.82 | DRD2 (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| SCHEMBL7561768 | 0.81 | DRD2 (0.94) | DRD3DRD2DRD4HTR1AADRA1D | |
| SCHEMBL14761722 | 0.81 | DRD2 (1.00) | DRD3DRD2DRD4HTR1AADRA1D | |
| Hydrochloric Acid SCHEMBL7595382 | 0.80 | DRD2 (0.94) | DRD3DRD2DRD4HTR1AADRA1D |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1749529-A1 | Utilisation of heteroarene carboxamide as dopamine-D3 ligands for the treatment of CNS diseases | SCHWARZ PHARMA AG (DE) | 2007-02-07 | — | — | EP | disclosed |
| EP-1733727-A1 | Ferrocenecarboxamide derivatives for use as dopamine D3 ligands for the treatment of CNS disorders | SCHWARZ PHARMA AG (DE) | 2006-12-20 | — | — | EP | disclosed |