Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 9/20 | 0.38 |
| ▸ | CNR1 | P21554 | 7/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | ACACA | Q13085 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL132109 | 0.84 | ACLY (0.43) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL20533115 | 0.84 | ACLY (0.43) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL132112 | 0.84 | ACLY (0.43) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL23217912 | 0.81 | ACLY (0.48) | ACLYPPARATSHRALDH1A1ACACB | |
| SCHEMBL23217911 | 0.81 | ACLY (0.48) | ACLYPPARATSHRALDH1A1ACACB | |
| Pivalate SCHEMBL30397349 | 0.73 | ALDH1A1 (0.42) | ACLYCNR2CNR1TRPA1TRPV1 | |
| Pivalate SCHEMBL28217624 | 0.73 | ALDH1A1 (0.42) | ACLYCNR2CNR1TRPA1TRPV1 | |
| SCHEMBL18704292 | 0.71 | ACLY (0.41) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL18704294 | 0.71 | ACLY (0.41) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL20101624 | 0.71 | CNR1 (0.32) | CNR2CNR1TRPA1TRPV1ALDH1A1 |
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-6844302-B1 | Encapsulated flavor and fragrance | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2005-01-18 | — | — | US | disclosed |