Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.30 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | NAAA | Q02083 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL1709436 | 1.00 | KDM4E (0.33) | KDM4EALDH1A1MGLLATMHTR2C | |
| SCHEMBL10032983 | 0.95 | KDM4E (0.32) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL1709440 | 0.95 | KDM4E (0.32) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL1709402 | 0.86 | HTR2C (0.34) | MGLLHTR2CHSD11B1SLC6A4SLC6A3 | |
| SCHEMBL1709356 | 0.86 | BCHE (0.35) | — | |
| SCHEMBL10032826 | 0.85 | — | — | |
| SCHEMBL10032978 | 0.84 | KDM4E (0.32) | KDM4EALDH1A1MGLLHSD11B1 | |
| SCHEMBL1709418 | 0.83 | BCHE (0.32) | HTR2CACHE | |
| SCHEMBL10032987 | 0.82 | PSEN1 (0.39) | MGLLHTR2CHSD11B1 | |
| SCHEMBL10032822 | 0.82 | HTR2C (0.33) | HTR2CHSD11B1 |
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 |