Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 9/20 | 0.44 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL9468865 | 0.77 | PLA2G4B (0.40) | DHFRGGPS1TSHRPLA2G4B | |
| SCHEMBL8699737 | 0.75 | GGPS1 (0.39) | DHFRGGPS1TSHR | |
| SCHEMBL15155730 | 0.74 | PPARG (0.47) | DHFR | |
| SCHEMBL9900879 | 0.74 | IDO1 (0.43) | — | |
| SCHEMBL15778630 | 0.73 | IDO1 (0.60) | — | |
| SCHEMBL8699358 | 0.73 | IDO1 (0.39) | — | |
| SCHEMBL8699363 | 0.71 | TSHR (0.38) | TSHRGPBAR1 | |
| SCHEMBL8703174 | 0.71 | MAPK1 (0.41) | TSHRCYP2D6 | |
| SCHEMBL8699741 | 0.71 | PPARA (0.43) | GGPS1 | |
| Hydrochloric Acid SCHEMBL10682415 | 0.71 | DHFR (0.46) | DHFRGGPS1TSHRPLA2G4BCYP2D6 |
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-2025001407-A1 | POLYARYL-CONTAINING MACROCYCLIC COMPOUNDS AND USES THEREOF | 浙江养生堂天然药物研究所有限公司 | 2025-01-02 | — | — | WO | disclosed |