Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.53 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30199299 | 1.00 | ESR2 (0.53) | ESR2NR1H2MRGPRX4MKNK1USP30 | |
| SCHEMBL29097943 | 0.86 | MRGPRX4 (0.52) | ESR2MRGPRX4HPGDUSP2MAPT | |
| SCHEMBL30474270 | 0.85 | NR1H2 (0.54) | ESR2NR1H2MKNK1USP30HTT | |
| SCHEMBL30198885 | 0.83 | ESR2 (0.53) | ESR2NR1H2GPR119CYP4F2CYP4A11 | |
| SCHEMBL30199620 | 0.83 | ESR2 (0.53) | ESR2NR1H2GPR119CYP4F2CYP4A11 | |
| SCHEMBL29097963 | 0.83 | ESR2 (0.53) | ESR2NR1H2GPR119CYP4F2CYP4A11 | |
| SCHEMBL29388008 | 0.81 | NR1H2 (0.72) | ESR2NR1H2MKNK1MAPTESR1 | |
| SCHEMBL30199070 | 0.81 | ESR2 (0.58) | ESR2NR1H2MAPTGPR119 | |
| SCHEMBL29097838 | 0.81 | ESR2 (0.58) | ESR2NR1H2MAPTGPR119 | |
| SCHEMBL30199177 | 0.81 | ESR2 (0.53) | ESR2NR1H2GPR119CYP4F2CYP4A11 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |