Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25600216 | 0.92 | HRH1 (0.40) | HRH1DRD3KDM2BDRD1DRD5 | |
| SCHEMBL25600320 | 0.88 | HRH1 (0.45) | HRH1DRD3KDM2BDRD1DRD5 | |
| SCHEMBL25595129 | 0.80 | KDM2B (0.35) | HRH1DRD3KDM2B | |
| SCHEMBL25595530 | 0.77 | HRH1 (0.36) | HRH1DRD3BRD4HTR2CCYP1A2 | |
| SCHEMBL25597203 | 0.76 | DRD3 (0.49) | HRH1DRD3DRD1DRD5HTR2A | |
| SCHEMBL25593050 | 0.73 | HRH1 (0.46) | HRH1DRD3HRH3LMNA | |
| SCHEMBL25817345 | 0.73 | HRH1 (0.45) | HRH1DRD3HRH3 | |
| SCHEMBL25593002 | 0.73 | PNMT (0.47) | HRH1DRD3HTR2AHTR2CHTR2B | |
| SCHEMBL25595531 | 0.71 | KDM2B (0.43) | HRH1DRD3KDM2BBRD4HTR2A | |
| SCHEMBL25602212 | 0.69 | HRH1 (0.40) | HRH1DRD3BRD4 |
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-2023088406-A1 | FUSED IMIDE DERIVATIVE | 正大天晴药业集团股份有限公司 | 2023-05-25 | — | — | WO | disclosed |