Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 2/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 14/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 14/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 14/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 14/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 14/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 14/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 12/20 | 0.48 |
| ▸ | NOS2 | P35228 | 2/20 | 0.47 |
| ▸ | NOS3 | P29474 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7851921 | 1.00 | BRS3 (0.66) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL15786956 | 0.92 | BRS3 (0.79) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL13068890 | 0.90 | BRS3 (0.70) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| Ufiprazole SCHEMBL29455226 | 0.88 | BRS3 (0.84) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| Ufiprazole SCHEMBL662986 | 0.88 | BRS3 (0.84) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL1717500 | 0.87 | BRS3 (0.66) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| Ufiprazole SCHEMBL7929368 | 0.87 | BRS3 (0.82) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| Ufiprazole SCHEMBL7950477 | 0.87 | BRS3 (0.82) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| Ufiprazole SCHEMBL31529606 | 0.87 | BRS3 (0.82) | BRS3HTTCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL14304171 | 0.87 | BRS3 (0.51) | BRS3HTTCYP2E1CYP2C8CYP2D6 |
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-118580219-A | Method for preparing esomeprazole potassium salt | 北京诺康达医药科技股份有限公司 | 2024-09-03 | — | — | CN | disclosed |