Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | MMP12 | P39900 | 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 | |
|---|---|---|---|---|
| SCHEMBL5608348 | 0.95 | EPHX1 (0.31) | EPHX1KDM4ECA2PTGS1MMP12 | |
| SCHEMBL5608314 | 0.89 | GAA (0.38) | — | |
| SCHEMBL16118629 | 0.89 | KDM4E (0.37) | EPHX1KDM4ECA2PTGS1MMP12 | |
| SCHEMBL11224012 | 0.89 | KDM4E (0.37) | EPHX1KDM4ECA2PTGS1MMP12 | |
| SCHEMBL1074030 | 0.85 | GAA (0.41) | — | |
| SCHEMBL5608449 | 0.85 | GAA (0.38) | — | |
| SCHEMBL23863822 | 0.81 | — | — | |
| SCHEMBL19766594 | 0.81 | — | — | |
| SCHEMBL20475966 | 0.80 | EPHX1 (0.31) | EPHX1KDM4ECA2PTGS1MMP12 | |
| SCHEMBL17780263 | 0.80 | EPHX1 (0.31) | EPHX1KDM4ECA2PTGS1MMP12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE39744-E1 | Adamantane derivatives and process for producing them | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2007-07-24 | — | — | US | disclosed |
| US-6392104-B1 | CHEMICAL INTERMEDIATES FOR DRUGS, AGRICULTURE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-05-21 | — | — | US | disclosed |
| EP-0927711-A1 | ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THEM | Daicel Chemical Industries, Ltd. (JP) | 1999-07-07 | — | — | EP | disclosed |