Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | JUN | P05412 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 2/20 | 0.39 |
| ▸ | GABRD | O14764 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL64740 | 0.98 | SIRT6 (0.57) | SIRT6MAPK1KDM4EL3MBTL1JUN | |
| SCHEMBL30196970 | 0.98 | SIRT6 (0.57) | SIRT6MAPK1KDM4EL3MBTL1JUN | |
| SCHEMBL68869 | 0.85 | MAPK1 (0.63) | SIRT6MAPK1KDM4EL3MBTL1PCSK9 | |
| SCHEMBL2646157 | 0.78 | SIRT6 (0.52) | SIRT6JUNNFKB1NFKB2RELA | |
| SCHEMBL30986210 | 0.78 | SIRT6 (0.52) | SIRT6MAPK1KDM4EL3MBTL1GABRP | |
| SCHEMBL31515460 | 0.78 | SIRT6 (0.52) | SIRT6JUNNFKB1NFKB2RELA | |
| SCHEMBL7999648 | 0.78 | SIRT6 (0.52) | SIRT6MAPK1KDM4EL3MBTL1GABRP | |
| SCHEMBL990711 | 0.78 | MAPK1 (0.55) | SIRT6MAPK1KDM4EL3MBTL1PCSK9 | |
| SCHEMBL5700876 | 0.78 | KDM4E (0.61) | SIRT6MAPK1KDM4EL3MBTL1PCSK9 | |
| SCHEMBL25153862 | 0.76 | MAPK1 (0.46) | MAPK1KDM4EL3MBTL1LCKGABRP |
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-107849056-A | BACE1 inhibitor 2 amino 7A phenyl 3,4,4A, 5,7,7A hexahydro furyl simultaneously [3,4 B] pyridine | H.隆德贝克有限公司 | 2018-03-27 | — | — | CN | disclosed |