Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 10/20 | 0.50 |
| ▸ | CA2 | P00918 | 10/20 | 0.50 |
| ▸ | CA9 | Q16790 | 8/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.50 |
| ▸ | CA7 | P43166 | 3/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.50 |
| ▸ | CA3 | P07451 | 2/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
| ▸ | CA6 | P23280 | 2/20 | 0.50 |
| ▸ | CA5A | P35218 | 2/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9715460 | 1.00 | CA1 (0.50) | CA1CA2CA9CA12CA7 | |
| SCHEMBL9715486 | 1.00 | CA1 (0.50) | CA1CA2CA9CA12CA7 | |
| SCHEMBL9715523 | 0.94 | CA1 (0.48) | CA1CA2CA9CA12CA7 | |
| SCHEMBL9715501 | 0.85 | CA1 (0.47) | CA1CA2CA9CA12CA7 | |
| SCHEMBL28872626 | 0.85 | CA1 (0.53) | CA1CA2CA9CA12CA7 | |
| SCHEMBL28838481 | 0.81 | CA1 (0.59) | CA1CA2CA9CA12CA7 | |
| SCHEMBL28628028 | 0.81 | CA1 (0.59) | CA1CA2CA9CA12CA7 | |
| SCHEMBL10784610 | 0.79 | CA1 (0.57) | CA1CA2CA9CA12CA7 | |
| SCHEMBL10779661 | 0.79 | CA1 (0.57) | CA1CA2CA9CA12CA7 | |
| SCHEMBL29166459 | 0.78 | CA2 (0.50) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0313939-B1 | OXIDATION OF THIOLS, DISULFIDES AND THIOLSULFONATES | ATOCHEM NORTH AMERICA, INC. (a Pennsylvania corp.) (US) | 1992-09-16 | — | — | EP | disclosed |
| US-4956494-A | Oxidation of thiols, disulfides and thiolsulfonates | PENNWALT CORPORATION (US) | 1990-09-11 | — | — | US | disclosed |
| EP-0313939-A2 | Oxidation of thiols, disulfides and thiolsulfonates | ATOCHEM NORTH AMERICA, INC. (a Pennsylvania corp.) (US) | 1989-05-03 | — | — | EP | disclosed |