Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 7/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1799182 | 0.89 | PRCP (0.53) | PRCPTSHRNPSR1GAAMAPT | |
| SCHEMBL95059 | 0.89 | PRCP (0.53) | PRCPTSHRNPSR1GAAMAPT | |
| SCHEMBL3087062 | 0.78 | CYP2D6 (0.38) | PRCPCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30435099 | 0.78 | CYP2D6 (0.38) | PRCPCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28823682 | 0.78 | HTR2C (0.43) | HTR1AADRA2A | |
| SCHEMBL28823708 | 0.78 | CAMK2A (0.47) | CAMK2AADRA2A | |
| SCHEMBL28823725 | 0.76 | LRRK2 (0.42) | — | |
| SCHEMBL28823672 | 0.75 | HTR2C (0.49) | — | |
| SCHEMBL13091446 | 0.73 | PRCP (0.49) | PRCPTSHRNPSR1GAAGID4 | |
| SCHEMBL28409392 | 0.73 | PRCP (0.46) | PRCPCYP1A2CYP2D6CYP2C9CYP2C19 |
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-116514824-A | Tri-ring compound, preparation method and application thereof | 上海科技大学 | 2023-08-01 | — | — | CN | disclosed |
| CN-115772175-A | Thieno-ring compounds, process for their preparation and their use | 中国科学院分子细胞科学卓越创新中心 | 2023-03-10 | — | — | CN | disclosed |