Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1548221 | 0.78 | HSD11B1 (0.41) | HSD11B1CYP2C9L3MBTL1HSD17B10TSHR | |
| SCHEMBL5401965 | 0.73 | HSD11B1 (0.48) | HSD11B1CYP2C9L3MBTL1HSD17B10P2RX7 | |
| SCHEMBL160953 | 0.70 | HSD11B1 (0.48) | HSD11B1CYP2C9L3MBTL1HSD17B10TSHR | |
| SCHEMBL2181379 | 0.70 | HSD11B1 (0.46) | HSD11B1CYP2C9L3MBTL1HSD17B10P2RX7 | |
| SCHEMBL27284428 | 0.70 | HSD11B1 (0.52) | HSD11B1CYP2C9L3MBTL1HSD17B10P2RX7 | |
| SCHEMBL19859959 | 0.70 | HSD11B1 (0.48) | HSD11B1CYP2C9L3MBTL1HSD17B10TSHR | |
| SCHEMBL16698251 | 0.70 | HSD11B1 (0.48) | HSD11B1CYP2C9L3MBTL1HSD17B10TSHR | |
| SCHEMBL6437296 | 0.70 | HSD11B1 (0.39) | HSD11B1CYP2C9L3MBTL1HSD17B10 | |
| SCHEMBL813578 | 0.69 | HSD11B1 (0.45) | HSD11B1CYP2C9L3MBTL1HSD17B10P2RX7 | |
| SCHEMBL177210 | 0.69 | HSD11B1 (0.45) | HSD11B1CYP2C9L3MBTL1HSD17B10CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109516986-A | Five nitros of 2,4,4,8,8- -2-aza-adamantane and its synthetic method | 南京理工大学 | 2019-03-26 | — | — | CN | claimed |
| CN-109516986-A | Five nitros of 2,4,4,8,8- -2-aza-adamantane and its synthetic method | 南京理工大学 | 2019-03-26 | — | — | CN | disclosed |
| CN-107556244-A | And cycle compound, its pharmaceutical composition and application | 上海迪诺医药科技有限公司 | 2018-01-09 | — | — | CN | disclosed |
| EP-0554244-A1 | ADAMANTANE POLYMERIC COMPOSITIONS | MOBIL OIL CORPORATION (US) | 1993-08-11 | — | — | EP | disclosed |
| WO-1992007018-A1 | ADAMANTANE POLYMERIC COMPOSITIONS | MOBIL OIL CORPORATION (US) | 1992-04-30 | — | — | WO | disclosed |
| US-5053434-A | Diamondoid polymeric compositions | MOBIL OIL CORPORATION (US) | 1991-10-01 | — | — | US | disclosed |