Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10032983 | 1.00 | KDM4E (0.32) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL10033181 | 0.95 | KDM4E (0.33) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL1709436 | 0.95 | KDM4E (0.33) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL10032978 | 0.89 | KDM4E (0.32) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL10032822 | 0.87 | HTR2C (0.33) | HSD11B1 | |
| SCHEMBL1709450 | 0.87 | HTR2C (0.33) | HSD11B1 | |
| SCHEMBL10032973 | 0.84 | SIGMAR1 (0.38) | — | |
| SCHEMBL1709370 | 0.84 | GPBAR1 (0.37) | — | |
| SCHEMBL10032990 | 0.83 | PSEN1 (0.38) | MGLLHSD11B1 | |
| SCHEMBL2315989 | 0.83 | PSEN1 (0.38) | MGLLHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |