Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | GRM1 | Q13255 | 8/20 | 0.38 |
| ▸ | GRM5 | P41594 | 7/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31284146 | 1.00 | NR1H2 (0.42) | NR1H2PDK4PDE10ANAMPTGRM1 | |
| SCHEMBL20934809 | 0.84 | PDK4 (0.42) | NR1H2PDK4PDE10ANAMPTGRM1 | |
| SCHEMBL3466461 | 0.80 | PDK4 (0.44) | NR1H2PDK4PDE10ANAMPTGRM1 | |
| SCHEMBL31589595 | 0.79 | GRM1 (0.43) | NR1H2PDK4NAMPTGRM1GRM5 | |
| SCHEMBL31155284 | 0.79 | PDE10A (0.49) | PDK4PDE10ANAMPTGRM1GRM5 | |
| SCHEMBL25345866 | 0.79 | PDE10A (0.49) | PDK4PDE10ANAMPTGRM1GRM5 | |
| SCHEMBL31589298 | 0.79 | GRM1 (0.43) | NR1H2PDK4NAMPTGRM1GRM5 | |
| SCHEMBL29220909 | 0.78 | GPR119 (0.54) | NR1H2PDK4NAMPTGRM1GRM5 | |
| SCHEMBL27202971 | 0.77 | PDK4 (0.52) | PDK4PDE10ANAMPTGRM1GRM5 | |
| SCHEMBL31097527 | 0.77 | PDK4 (0.51) | PDK4NAMPTGRM1GRM5JAK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119176772-A | Compound with Mrgpr X receptor inhibition effect and application thereof | 博济医药科技股份有限公司 | 2024-12-24 | — | — | CN | disclosed |