Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 16/20 | 0.59 |
| ▸ | DRD2 | P14416 | 14/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13448941 | 0.89 | ALDH1A1 (0.61) | DRD4DRD2ALDH1A1CYP2D6 | |
| SCHEMBL13448942 | 0.77 | DRD2 (0.54) | DRD4DRD2ALDH1A1CYP2D6 | |
| SCHEMBL7659719 | 0.74 | DRD4 (1.00) | DRD4DRD2 | |
| SCHEMBL21250732 | 0.69 | DRD4 (0.63) | DRD4DRD2ALDH1A1 | |
| SCHEMBL18711265 | 0.67 | NOTUM (0.69) | DRD4DRD2ALDH1A1CYP2D6 | |
| SCHEMBL15746090 | 0.66 | NOTUM (0.67) | DRD4DRD2ALDH1A1CYP2D6 | |
| SCHEMBL11438312 | 0.66 | NOTUM (0.67) | DRD4DRD2ALDH1A1CYP2D6 | |
| SCHEMBL4220630 | 0.65 | ALDH1A1 (0.61) | DRD4DRD2ALDH1A1CYP2D6 | |
| SCHEMBL10859231 | 0.64 | NOTUM (0.69) | ALDH1A1 | |
| SCHEMBL1865732 | 0.64 | NOTUM (0.73) | ALDH1A1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160196412-A1 | DESIGN OF MOLECULES | RECURSION PHARMACEUTICALS, INC. | 2016-07-07 | — | — | US | disclosed |
| US-20160196412-A1 | DESIGN OF MOLECULES | RECURSION PHARMACEUTICALS, INC. | 2016-07-07 | — | — | US | disclosed |