Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL4647387 | 0.84 | GABRA1 (0.48) | GABRA1GABRB1GABRB2SLC6A2SLC6A4 | |
| SCHEMBL12197671 | 0.78 | GABRA1 (0.52) | GABRA1GABRB1GABRB2SLC6A2TRPA1 | |
| SCHEMBL5486247 | 0.76 | CASP1 (0.48) | SLC6A2TRPA1LMNACHRM1ADRA1A | |
| SCHEMBL49477 | 0.76 | CASP1 (0.48) | SLC6A2TRPA1LMNACHRM1ADRA1A | |
| SCHEMBL16860570 | 0.76 | GABRA1 (0.44) | GABRA1GABRB1GABRB2SLC6A2TRPA1 | |
| SCHEMBL29368425 | 0.76 | CASP1 (0.48) | SLC6A2TRPA1LMNACHRM1ADRA1A | |
| SCHEMBL3847726 | 0.74 | TRPA1 (0.56) | SLC6A2TRPA1LMNACHRM1ADRA1A | |
| Hydrochloric Acid SCHEMBL11217552 | 0.74 | CASP1 (0.46) | SLC6A2TRPA1LMNACHRM1ADRA1A | |
| SCHEMBL12224190 | 0.74 | GABRA1 (0.43) | GABRA1GABRB1GABRB2SLC6A2TRPA1 | |
| SCHEMBL2244195 | 0.74 | ALDH1A1 (0.59) | GABRA1GABRB2SLC6A2TRPA1LMNA |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020039092-A2 | NOVEL AROMATIC MOLECULES | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| WO-2020039094-A1 | PHENOXY(HETERO)ARYL ETHERS OF ANTIPROLIFERATIVE ACTIVITY | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| WO-2020039088-A2 | NOVEL COMPOUNDS | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| US-9403829-B2 | Pharmaceutical compositions of 7-(6-(2-hydroxypropan-2-yl)pyridin-3-yl)-1-((trans)-4-methoxycyclohexyl)-3,4-dihydropyrazino [2,3-b]pyrazin-2(1H)-one, a solid form thereof and methods of their use | SIGNAL PHARMACEUTICALS, LLC (US) | 2016-08-02 | — | — | US | disclosed |
| CN-1069312-C | Substituted imidogen sulfamide, its preparation, use and medicines containing the same | HOECHST AG (DE) | 2001-08-08 | — | — | CN | disclosed |
| CN-1155538-A | Substituted imidogen sulfamide, its preparation, use and medicines containing the same | HOECHST AG (DE) | 1997-07-30 | — | — | CN | disclosed |