Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PTGES | O14684 | 2/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7382016 | 0.82 | PPARG (0.48) | PPARGLMNAPTGESALOX5PPARA | |
| SCHEMBL4986368 | 0.81 | PPARG (0.37) | PPARGLMNAPTGESALOX5PPARA | |
| SCHEMBL4987597 | 0.77 | ESR1 (0.34) | PPARGPTGESALOX5PPARAKDM4C | |
| SCHEMBL28741273 | 0.77 | MAPK1 (0.40) | PPARGLMNACA2MAPK1PTGES | |
| SCHEMBL4986561 | 0.76 | PPARG (0.36) | PPARGLMNAPTGESALOX5PPARA | |
| Acetic Acid SCHEMBL6269761 | 0.76 | CTBP2 (0.42) | PPARGPPARAKDM4CESR1ESR2 | |
| SCHEMBL585398 | 0.76 | CYP1A2 (0.59) | PPARGCA2MAPK1PPARACYP1A2 | |
| Hydrogen Peroxide SCHEMBL28094650 | 0.75 | ESR1 (0.46) | MAPK1KDM4CESR1ESR2POLB | |
| SCHEMBL9469381 | 0.75 | TAAR1 (0.46) | CYP1A2NR3C2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28284494 | 0.75 | CYP1A2 (0.57) | PPARGCA2MAPK1PPARACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20150216182-A1 | COMPOSITIONS AND METHODS OF THE ATTRACTION AND REPULSION OF INSECTS | OLFACTOR LABORATORIES, INC. | 2015-08-06 | — | — | US | disclosed |
| US-20070088508-A1 | Cocrystallization methods | APTUIT (WEST LAFAYETTE), LLC | 2007-04-19 | — | — | US | disclosed |
| WO-2007038524-A2 | COCRYSTALLIZATION METHODS | SSCI, INC. (US) | 2007-04-05 | — | — | WO | disclosed |