Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | IL6 | P05231 | 2/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.31 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1978283 | 1.00 | ALDH1A1 (0.36) | ALDH1A1ELANEDRD1IL6ITGAL | |
| SCHEMBL1979286 | 0.92 | MAPT (0.32) | ALDH1A1ELANEITGALNPBWR1MCHR1 | |
| SCHEMBL30939587 | 0.92 | MAPT (0.32) | ALDH1A1ELANEITGALNPBWR1MCHR1 | |
| SCHEMBL30939519 | 0.88 | AR (0.35) | DRD1ITGALAR | |
| SCHEMBL1979866 | 0.88 | AR (0.35) | DRD1ITGALAR | |
| SCHEMBL18963091 | 0.88 | AR (0.31) | ITGALAR | |
| SCHEMBL30939507 | 0.88 | DRD1 (0.37) | ALDH1A1ELANEDRD1IL6NPBWR1 | |
| SCHEMBL1980315 | 0.88 | DRD1 (0.37) | ALDH1A1ELANEDRD1IL6NPBWR1 | |
| SCHEMBL21580678 | 0.86 | ALDH1A1 (0.36) | ALDH1A1ELANEDRD1IL6ITGAL | |
| SCHEMBL13832575 | 0.85 | DRD1 (0.33) | ALDH1A1DRD1NPBWR1MCHR1MEN1 |
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-118267386-A | Modulators of KV3 channels for the treatment of pain | 奥提芙尼治疗学有限公司 | 2024-07-02 | — | — | CN | disclosed |
| CN-108472288-B | Modulators of KV3 channels for the treatment of pain | 奥提芙尼治疗学有限公司 | 2024-05-28 | — | — | CN | disclosed |