Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 10/20 | 0.44 |
| ▸ | CA1 | P00915 | 6/20 | 0.44 |
| ▸ | CA9 | Q16790 | 6/20 | 0.44 |
| ▸ | CA12 | O43570 | 4/20 | 0.44 |
| ▸ | CA7 | P43166 | 4/20 | 0.44 |
| ▸ | CA4 | P22748 | 3/20 | 0.44 |
| ▸ | CA6 | P23280 | 3/20 | 0.44 |
| ▸ | CA5A | P35218 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.44 |
| ▸ | CA3 | P07451 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11678376 | 0.95 | CA2 (0.46) | CA2CA1CA9CA12CA7 | |
| SCHEMBL4673949 | 0.79 | CA2 (0.46) | CA2CA1CA9CA12CA7 | |
| SCHEMBL30892432 | 0.79 | CA2 (0.46) | CA2CA1CA9CA12CA7 | |
| SCHEMBL28540894 | 0.79 | CA2 (0.46) | CA2CA1CA9CA12CA7 | |
| SCHEMBL28681702 | 0.77 | GABRP (0.38) | CA2CA1CA9CA12CA7 | |
| SCHEMBL32664283 | 0.76 | TYR (0.44) | CA2CA1CA9ALDH1A1TSHR | |
| SCHEMBL7777711 | 0.74 | CA2 (0.45) | CA2CA1CA9CA12CA7 | |
| SCHEMBL28906302 | 0.74 | CA2 (0.45) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL7950712 | 0.74 | CA2 (0.57) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL28605818 | 0.74 | CA2 (0.45) | CA2CA1CA9CA12ALDH1A1 |
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-4062952-A | Substituted benzenedisulfonamides as anthelmintics | MERCK & CO., INC. (US) | 1977-12-13 | — | — | US | claimed |
| US-4062952-A | Substituted benzenedisulfonamides as anthelmintics | MERCK & CO., INC. (US) | 1977-12-13 | — | — | US | disclosed |