Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 6/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | FPR1 | P21462 | 1/20 | 0.35 |
| ▸ | FPR3 | P25089 | 1/20 | 0.35 |
| ▸ | GPR183 | P32249 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19875811 | 0.84 | TSHR (0.62) | TSHRACHEGRM5ALDH1A1FFAR1 | |
| SCHEMBL49876 | 0.79 | — | — | |
| SCHEMBL1141159 | 0.73 | TSHR (0.62) | TSHRACHEGRM5ALDH1A1FFAR1 | |
| SCHEMBL30666154 | 0.73 | TSHR (0.62) | TSHRACHEGRM5ALDH1A1FFAR1 | |
| SCHEMBL3644208 | 0.73 | TSHR (0.62) | TSHRACHEGRM5ALDH1A1FFAR1 | |
| SCHEMBL4578330 | 0.70 | — | — | |
| SCHEMBL22573258 | 0.70 | TSHR (0.78) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL10817957 | 0.69 | — | — | |
| SCHEMBL7393891 | 0.69 | — | — | |
| SCHEMBL195169 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011033251-A1 | HERBICIDAL ISOXAZOLINE DERIVATIVES | SYNGENTA LIMITED (GB) | 2011-03-24 | — | — | WO | disclosed |
| US-6048863-A | SEXUAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-04-11 | — | — | US | disclosed |