Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 9/20 | 0.34 |
| ▸ | CA2 | P00918 | 9/20 | 0.34 |
| ▸ | CA9 | Q16790 | 8/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA7 | P43166 | 3/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | CA6 | P23280 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 2/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL10549042 | 0.88 | CA1 (0.42) | CA1CA2CA9CA12CA7 | |
| SCHEMBL28326935 | 0.82 | TP53 (0.37) | CA1CA2CA9CA12CA7 | |
| SCHEMBL11759627 | 0.78 | TP53 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8995431 | 0.78 | ALDH1A1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL1974092 | 0.76 | TP53 (0.44) | CA1CA2CA9CA12CA7 | |
| SCHEMBL11220835 | 0.76 | USP2 (0.42) | CA1CA2CA9CA12CA7 | |
| SCHEMBL9822598 | 0.76 | CA1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL1668699 | 0.75 | MEN1 (0.33) | TSHR | |
| Ammonia Solution, Strong SCHEMBL29166538 | 0.75 | TP53 (0.43) | CA1CA2CA9CA12CA7 | |
| Ammonia Solution, Strong SCHEMBL29166217 | 0.75 | TP53 (0.43) | CA1CA2CA9CA12CA7 |
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-105745235-A | Alkoxylates of S-vinylthioalkanols | 巴斯夫欧洲公司 | 2016-07-06 | — | — | CN | claimed |