Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | EED | O75530 | 2/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.34 |
| ▸ | HTR3B | O95264 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.34 |
| ▸ | TTBK2 | Q6IQ55 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7405118 | 0.86 | HDAC3 (0.44) | GAALMNAL3MBTL1PARP1POLB | |
| SCHEMBL15761189 | 0.79 | ABCG2 (0.39) | ABCG2GAALMNAGSK3BKDM4C | |
| SCHEMBL29625406 | 0.79 | PARP1 (0.54) | LMNACHEK1CHEK2PARP1SYK | |
| SCHEMBL1720148 | 0.79 | PARP1 (0.54) | LMNACHEK1CHEK2PARP1SYK | |
| SCHEMBL17064119 | 0.79 | EED (0.43) | ABCG2GAALMNAGSK3BEED | |
| SCHEMBL9440489 | 0.75 | ABCG2 (0.38) | ABCG2GAALMNAGSK3BEED | |
| SCHEMBL6206600 | 0.74 | ABCG2 (0.44) | ABCG2GAALMNAGSK3BKDM4C | |
| SCHEMBL29442138 | 0.73 | KDM4C (0.52) | ABCG2LMNAGSK3BKDM4CMAOB | |
| SCHEMBL340702 | 0.73 | KDM4C (0.52) | ABCG2LMNAGSK3BKDM4CMAOB | |
| SCHEMBL23079145 | 0.71 | GSK3B (0.42) | ABCG2GAALMNAGSK3BKDM4C |
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 |
|---|---|---|---|---|---|---|---|
| EP-2906553-B1 | OREXIN RECEPTOR ANTAGONISTS WHICH ARE [ORTHO BI (HETERO )ARYL]-[2-(META BI (HETERO)ARYL)-PYRROLIDIN-1-YL]-METHANONE DERIVATIVES | IDORSIA PHARMACEUTICALS LTD (CH) | 2019-06-26 | — | — | EP | disclosed |