Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.55 |
| ▸ | CA1 | P00915 | 6/20 | 0.55 |
| ▸ | CA9 | Q16790 | 4/20 | 0.55 |
| ▸ | CA12 | O43570 | 3/20 | 0.55 |
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8514633 | 0.80 | CA2 (0.59) | CA2CA1CA9CA12IDO1 | |
| SCHEMBL8779885 | 0.79 | CA2 (0.41) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL1332778 | 0.78 | CA2 (0.57) | CA2CA1CA9CA12IDO1 | |
| SCHEMBL1894003 | 0.78 | CA2 (0.57) | CA2CA1CA9CA12IDO1 | |
| SCHEMBL2719708 | 0.77 | CA1 (0.52) | CA2CA1CA9CA12IDO1 | |
| Silver SCHEMBL4326545 | 0.76 | CA2 (0.55) | CA2CA1CA9CA12IDO1 | |
| SCHEMBL61854 | 0.76 | CA1 (0.55) | CA2CA1CA9CA12IDO1 | |
| SCHEMBL28445682 | 0.76 | CA2 (0.55) | CA2CA1CA9CA12IDO1 | |
| SCHEMBL803901 | 0.76 | PTGS2 (0.68) | CA2CA1CA9CA12CYP19A1 | |
| SCHEMBL1894004 | 0.76 | CA2 (0.55) | CA2CA1CA9CA12IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0770599-A1 | PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1997-05-02 | — | — | EP | disclosed |