Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 8/20 | 0.35 |
| ▸ | P2RX2 | Q9UBL9 | 8/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29527168 | 1.00 | GABRA1 (0.41) | GABRA1GABRB1P2RX3P2RX2PIK3CA | |
| SCHEMBL9948731 | 0.83 | PIK3CA (0.33) | PIK3CAMTORDYRK1BHTTKMT2A | |
| SCHEMBL5781035 | 0.83 | PIK3CA (0.33) | PIK3CAMTORDYRK1BHTTKMT2A | |
| SCHEMBL18751309 | 0.83 | GABRA1 (0.39) | GABRA1GABRB1HTTKMT2A | |
| SCHEMBL15314666 | 0.79 | GABRA1 (0.30) | GABRA1GABRB1 | |
| SCHEMBL16133709 | 0.78 | GABRA1 (0.35) | GABRA1P2RX3P2RX2PIK3CAMTOR | |
| SCHEMBL15292546 | 0.78 | PIK3R1 (0.36) | P2RX3P2RX2PIK3CAPOLBGAA | |
| SCHEMBL31451331 | 0.78 | TSHR (0.34) | PIK3CAGAAMTORMAPT | |
| SCHEMBL22959247 | 0.77 | PIK3R1 (0.35) | GABRA1GABRB1P2RX3P2RX2PIK3CA | |
| SCHEMBL11890406 | 0.77 | TSHR (0.43) | GABRA1GABRB1P2RX3P2RX2PIK3CA |
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-113698388-B | 6-oxo-1, 6-dihydropyridine derivative, preparation method and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2022-11-22 | — | — | CN | disclosed |
| CN-113698388-A | 6-oxo-1, 6-dihydropyridine derivatives, preparation method and application thereof in medicines | 江苏恒瑞医药股份有限公司 | 2021-11-26 | — | — | CN | disclosed |