Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.31 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11143715 | 0.76 | TSHR (0.37) | TSHRALOX15GRIK1GRIK2 | |
| SCHEMBL735056 | 0.75 | TSHR (0.34) | TSHRALOX15ALDH1A1GRIK1GRIK2 | |
| Bromide SCHEMBL28859977 | 0.73 | TSHR (0.33) | TSHRALOX15ALDH1A1GRIK1GRIK2 | |
| SCHEMBL11794760 | 0.72 | — | — | |
| SCHEMBL10878954 | 0.70 | GRIK1 (0.41) | TSHRALOX15ALDH1A1GRIK1GRIK2 | |
| SCHEMBL2440971 | 0.70 | GRIK1 (0.41) | TSHRALOX15ALDH1A1GRIK1GRIK2 | |
| SCHEMBL2048567 | 0.70 | — | — | |
| SCHEMBL11436935 | 0.70 | GRIK1 (0.34) | ALOX15GRIK1GRIK2 | |
| SCHEMBL8391852 | 0.69 | — | — | |
| SCHEMBL132111 | 0.68 | GRIK1 (0.48) | ALDH1A1GRIK1GRIK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4447365-A | ORGANOLEPTIC AGENT | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1984-05-08 | — | — | US | disclosed |
| US-4390463-A | Process for augmenting or enhancing the aroma of perfume compositions and colognes utilizing alkyl, aralkyl, and bicycloalkyl methyl carbonates | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1983-06-28 | — | — | US | disclosed |