Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.38 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL14370458 | 0.97 | ALDH1A1 (0.45) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Hydrogen Sulfide SCHEMBL28112419 | 0.80 | HDAC3 (0.42) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| SCHEMBL5270259 | 0.77 | HDAC3 (0.43) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Hydrogen Sulfide SCHEMBL28099748 | 0.77 | FAAH (0.43) | ALDH1A1TSHRTDP1 | |
| SCHEMBL2864735 | 0.76 | TDP1 (0.40) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| SCHEMBL5825706 | 0.74 | TSHR (0.43) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL9616754 | 0.74 | ALDH1A1 (0.43) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL2311220 | 0.74 | TSHR (0.43) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL27492133 | 0.73 | FAAH (0.45) | ALDH1A1TSHRTDP1 | |
| SCHEMBL567250 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106172876-A | For giving powdered oil compositions and the adding method thereof of breast local flavor | 长谷川香料株式会社 | 2016-12-07 | — | — | CN | disclosed |
| CN-104093695-B | Capric acid derivatives and perfume compositions | 长谷川香料株式会社 | 2016-08-31 | — | — | CN | disclosed |