Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | TLR2 | O60603 | 1/20 | 0.32 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20025191 | 0.91 | CYP4A11 (0.46) | PPARACYP4F2CYP4A11MTNR1AMTNR1B | |
| SCHEMBL18741306 | 0.88 | KCNH2 (0.41) | PPARACYP4F2CYP4A11TDP1HDAC8 | |
| SCHEMBL20025313 | 0.87 | PPARD (0.41) | PPARA | |
| SCHEMBL18741285 | 0.87 | MTNR1A (0.34) | PPARAPPARGCYP4F2CYP4A11MTNR1A | |
| SCHEMBL18741368 | 0.87 | MEN1 (0.40) | PPARAPPARGCYP4F2CYP4A11MTNR1A | |
| SCHEMBL8088565 | 0.87 | HPGD (0.39) | — | |
| SCHEMBL20025315 | 0.87 | CA1 (0.34) | PPARGCYP4F2CYP4A11MTNR1AMTNR1B | |
| SCHEMBL13225847 | 0.87 | GAA (0.42) | PPARAPPARGNR1H3HDAC8 | |
| SCHEMBL18761953 | 0.87 | CYP4F2 (0.36) | PPARAPPARGCYP4F2CYP4A11MTNR1A | |
| SCHEMBL19294595 | 0.87 | PPARD (0.41) | PPARA |
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-2018059537-A1 | DIAZASPIRO[5.5]UNDECANE DERIVATIVE AND USE THEREOF | 四川海思科制药有限公司 | 2018-04-05 | — | — | WO | disclosed |