Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL26330565 | 0.85 | TSHR (0.52) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL14453899 | 0.85 | TSHR (0.61) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL13246484 | 0.84 | TSHR (0.50) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL172650 | 0.84 | TSHR (0.50) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL10127440 | 0.84 | TSHR (0.50) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL29516747 | 0.84 | TSHR (0.50) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL13464527 | 0.84 | TSHR (0.50) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL1195445 | 0.82 | CA1 (0.50) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL27622929 | 0.82 | TSHR (0.48) | TACR1TSHRCA1CA2CA7 | |
| SCHEMBL27622931 | 0.82 | TSHR (0.48) | TACR1TSHRCA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108368083-A | heteroaryl compounds and their use as therapeutic agents | 东亚首希控股股份有限公司 | 2018-08-03 | — | — | CN | disclosed |