Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 17/20 | 0.75 |
| ▸ | DRD3 | P35462 | 14/20 | 0.75 |
| ▸ | DRD4 | P21917 | 7/20 | 0.75 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.67 |
| ▸ | HTR1A | P08908 | 5/20 | 0.54 |
| ▸ | HTR2A | P28223 | 3/20 | 0.54 |
| ▸ | HTR2C | P28335 | 3/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.52 |
| ▸ | DRD1 | P21728 | 2/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.52 |
| ▸ | HTR2B | P41595 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29462329 | 0.89 | DRD3 (0.77) | DRD2DRD3DRD4ADRA1ATP53 | |
| SCHEMBL2315158 | 0.89 | DRD3 (0.77) | DRD2DRD3DRD4ADRA1ATP53 | |
| SCHEMBL2318865 | 0.89 | DRD2 (0.69) | DRD2DRD3DRD4ADRA1AHTR1A | |
| SCHEMBL28933663 | 0.86 | DRD3 (0.75) | DRD2DRD3DRD4ADRA1AHTR1A | |
| SCHEMBL2314544 | 0.83 | DRD2 (0.69) | DRD2DRD3DRD4ADRA1AHTR1A | |
| SCHEMBL2319168 | 0.82 | DRD3 (0.67) | DRD2DRD3DRD4ADRA1ALMNA | |
| Hydrochloric Acid SCHEMBL7535217 | 0.79 | DRD2 (0.73) | DRD2DRD3DRD4ADRA1AHTR1A | |
| Hydrochloric Acid SCHEMBL7534126 | 0.79 | DRD2 (0.92) | DRD2DRD3DRD4ADRA1AHTR1A | |
| Hydrochloric Acid SCHEMBL8204882 | 0.77 | DRD2 (0.67) | DRD2DRD3DRD4ADRA1AHTR1A | |
| Hydrochloric Acid SCHEMBL7540561 | 0.77 | DRD2 (0.70) | DRD2DRD3DRD4ADRA1AHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109419802-B | Compounds having dopamine D3 receptor modulating activity and uses thereof | 中国人民解放军军事医学科学院毒物药物研究所（CN） | 2023-01-13 | — | — | CN | claimed |
| CN-109419802-B | Compounds having dopamine D3 receptor modulating activity and uses thereof | 中国人民解放军军事医学科学院毒物药物研究所（CN） | 2023-01-13 | — | — | CN | disclosed |