Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 12/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.30 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20439751 | 0.85 | GRM2 (0.53) | GRM2SLC9A1NFE2L2KEAP1 | |
| SCHEMBL29356302 | 0.80 | GRM2 (0.47) | GRM2NPC1 | |
| SCHEMBL4083654 | 0.80 | GRM2 (0.47) | GRM2NPC1 | |
| SCHEMBL22084730 | 0.75 | KEAP1 (0.41) | NPC1SLC9A1NFE2L2KEAP1RAB9A | |
| SCHEMBL22084732 | 0.73 | KDM4E (0.32) | KDM4EMAPTMAPK1 | |
| SCHEMBL3269772 | 0.72 | GRM2 (0.40) | GRM2SLC9A1MAPTMAPK1 | |
| SCHEMBL5162819 | 0.71 | GRM2 (0.34) | GRM2GAAKDM4E | |
| SCHEMBL6933331 | 0.69 | GRM2 (0.35) | GRM2SLC9A1GAAKDM4E | |
| SCHEMBL19990152 | 0.69 | GRM2 (0.44) | GRM2 | |
| SCHEMBL17728250 | 0.69 | NAMPT (0.49) | NPC1SLC9A1RAB9AGAASMN1; SMN2 |
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-112410009-B | Gas well corrosion inhibitor for shale gas development and preparation method thereof | 滨州市广友化工有限公司 | 2022-12-20 | — | — | CN | claimed |
| CN-112410009-A | Gas well corrosion inhibitor for shale gas development and preparation method thereof | 滨州市广友化工有限公司 | 2021-02-26 | — | — | CN | claimed |