Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL27629674 | 0.82 | PPARG (0.43) | PPARGPPARA | |
| SCHEMBL12444920 | 0.74 | TSHR (0.50) | CA1CA2CA7CA9TSHR | |
| SCHEMBL12444919 | 0.74 | TSHR (0.50) | CA1CA2CA7CA9TSHR | |
| SCHEMBL353816 | 0.73 | ALPI (0.41) | SLC1A1ALDH1A1 | |
| SCHEMBL22619569 | 0.72 | CA1 (0.43) | CA1CA2CA7CA9TSHR | |
| Sulfuric Acid SCHEMBL21681660 | 0.72 | TSHR (0.71) | CA1CA2CA7CA9TSHR | |
| SCHEMBL27610657 | 0.72 | CA1 (0.47) | CA1CA2CA7CA9SLC1A1 | |
| SCHEMBL27610658 | 0.72 | CA1 (0.47) | CA1CA2CA7CA9SLC1A1 | |
| Ammonia Solution, Strong SCHEMBL27610656 | 0.71 | CSNK1E (0.50) | — | |
| Sulfuric Acid SCHEMBL11103734 | 0.70 | TSHR (0.68) | CA1CA2CA7CA9TSHR |
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-100436409-C | Derivative of substitutional taurine and preparation method | UNIV BEIJING (CN) | 2008-11-26 | — | — | CN | disclosed |
| CN-1696109-A | Derivative of substitutional taurine and preparation method | UNIV BEIJING (CN) | 2005-11-16 | — | — | CN | disclosed |