Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 3/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TEK | Q02763 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20406168 | 0.89 | PDE10A (0.47) | DRD1CYP17A1GPBAR1PDE10AKDR | |
| SCHEMBL20406667 | 0.86 | DRD1 (0.42) | DRD1GPBAR1PDE10A | |
| SCHEMBL18661463 | 0.84 | KDR (0.42) | CYP17A1GPBAR1PDE10AKDRTEK | |
| SCHEMBL18661500 | 0.83 | CYP17A1 (0.43) | DRD1CYP17A1CYP1A2GPBAR1PDE10A | |
| SCHEMBL20406580 | 0.83 | GPBAR1 (0.40) | DRD1GPBAR1PDE10A | |
| SCHEMBL18661464 | 0.82 | KMT2A (0.43) | DRD1PDE10A | |
| SCHEMBL18661462 | 0.82 | GPBAR1 (0.39) | DRD1GPBAR1PDE10A | |
| SCHEMBL20755024 | 0.81 | GPBAR1 (0.41) | DRD1GPBAR1PDE10A | |
| SCHEMBL20406584 | 0.81 | GPBAR1 (0.41) | DRD1GPBAR1PDE10A | |
| SCHEMBL20406772 | 0.81 | PDE10A (0.44) | DRD1CYP17A1CYP1A2PDE10A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3351533-A1 | BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME | Kaken Pharmaceutical Co., Ltd. (JP) | 2018-07-25 | — | — | EP | disclosed |