Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | TRPM7 | Q96QT4 | 1/20 | 0.48 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | INHA | P05111 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.43 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.43 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16212952 | 0.95 | CYP19A1 (0.53) | CYP19A1SLC6A3TRPM7DAGLAPPARG | |
| SCHEMBL16212552 | 0.85 | CYP19A1 (0.68) | CYP19A1SLC6A3TRPM7DAGLAPPARG | |
| SCHEMBL18291006 | 0.82 | CNR2 (0.51) | PPARGPPARDPPARACNR2ESR1 | |
| SCHEMBL16212537 | 0.77 | CNR2 (0.48) | PPARGPPARDPPARACNR2ESR1 | |
| SCHEMBL21864135 | 0.75 | SLC6A3 (0.76) | CYP19A1SLC6A3TRPM7DAGLAPPARG | |
| SCHEMBL9260013 | 0.72 | CYP19A1 (0.59) | CYP19A1SLC6A3TRPM7DAGLAPPARG | |
| SCHEMBL27329793 | 0.71 | CYP19A1 (0.56) | CYP19A1SLC6A3TRPM7DAGLAPPARG | |
| SCHEMBL18290999 | 0.70 | PPARG (0.46) | CYP19A1PPARGPPARAESR1 | |
| SCHEMBL24596011 | 0.70 | SLC6A3 (0.76) | CYP19A1SLC6A3TRPM7DAGLAPPARG | |
| SCHEMBL9029687 | 0.70 | CNR1 (0.76) | CYP19A1SLC6A3TRPM7DAGLAPPARG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014177593-A1 | AMORFRUTIN ANALOGS AS PPARGAMMA-MODULATORS | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-11-06 | — | — | WO | claimed |
| WO-2014177593-A1 | AMORFRUTIN ANALOGS AS PPARGAMMA-MODULATORS | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-11-06 | — | — | WO | disclosed |
| WO-2014177593-A1 | AMORFRUTIN ANALOGS AS PPARGAMMA-MODULATORS | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-11-06 | — | — | WO | disclosed |