Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 12/20 | 0.39 |
| ▸ | PPARA | Q07869 | 12/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 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 | |
|---|---|---|---|---|
| SCHEMBL20244408 | 0.85 | PPARG (0.43) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL24751622 | 0.81 | PPARG (0.40) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL15702013 | 0.79 | LMNA (0.35) | LMNAHTR1DTRPA1PTGS1CACNA1C | |
| SCHEMBL25893405 | 0.77 | PPARG (0.36) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL18931958 | 0.77 | LMNA (0.50) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL27252554 | 0.77 | PPARG (0.38) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL14087991 | 0.76 | ALDH1A1 (0.46) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL21508221 | 0.76 | HTR1D (0.38) | PPARGPPARALMNAHTR1DTRPA1 | |
| SCHEMBL5166281 | 0.76 | ALDH1A1 (0.50) | PPARGPPARALMNATRPA1PTGS1 | |
| SCHEMBL21507887 | 0.76 | PPARG (0.42) | PPARGPPARALMNAHTR1DTRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9121110-B2 | Quasirandom structure and function guided synthesis methods | NUEVOLUTION A/S (DK) | 2015-09-01 | — | — | US | disclosed |