Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.46 |
| ▸ | GHSR | Q92847 | 5/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29097828 | 1.00 | NR1H2 (0.58) | NR1H2ESR2HDAC8GPR119GHSR | |
| SCHEMBL14781466 | 0.96 | ESR2 (0.63) | NR1H2ESR2GPR119GHSRHRH3 | |
| SCHEMBL30199070 | 0.91 | ESR2 (0.58) | NR1H2ESR2GPR119GHSRHRH3 | |
| SCHEMBL29097838 | 0.91 | ESR2 (0.58) | NR1H2ESR2GPR119GHSRHRH3 | |
| SCHEMBL29098082 | 0.91 | NR1H2 (0.57) | NR1H2ESR2HDAC8GPR119GHSR | |
| SCHEMBL30200125 | 0.91 | NR1H2 (0.57) | NR1H2ESR2HDAC8GPR119GHSR | |
| SCHEMBL29098095 | 0.91 | NR1H2 (0.57) | NR1H2ESR2GPR119GHSRHRH3 | |
| SCHEMBL30199521 | 0.91 | NR1H2 (0.57) | NR1H2ESR2GPR119GHSRHRH3 | |
| SCHEMBL30199590 | 0.90 | NR1H2 (0.60) | NR1H2ESR2HDAC8GHSRHRH3 | |
| SCHEMBL30199290 | 0.89 | NR1H2 (0.55) | NR1H2ESR2GPR119GHSRHRH3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115594669-B | Parallel ring derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2024-11-05 | — | — | CN | disclosed |
| CN-115594669-A | Fused ring derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |