Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 13/20 | 0.39 |
| ▸ | CA2 | P00918 | 13/20 | 0.39 |
| ▸ | CA9 | Q16790 | 11/20 | 0.39 |
| ▸ | CA12 | O43570 | 9/20 | 0.39 |
| ▸ | CA4 | P22748 | 3/20 | 0.35 |
| ▸ | CA6 | P23280 | 3/20 | 0.35 |
| ▸ | CA5A | P35218 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.35 |
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10369410 | 0.75 | CA2 (0.37) | CA1CA2CA9CA12CA4 | |
| SCHEMBL1727749 | 0.75 | CA2 (0.39) | CA1CA2CA9CA12CA4 | |
| SCHEMBL8024079 | 0.71 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL11633944 | 0.67 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL308829 | 0.67 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL10860629 | 0.67 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL11638030 | 0.67 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL30430615 | 0.67 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL308828 | 0.67 | GPR3 (0.41) | CA1CA2CA9CA12GPR3 | |
| SCHEMBL13434050 | 0.65 | CTDSP1 (0.37) | GPR3MEN1KMT2ACTDSP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000063202-A2 | BENZO[b] THIOPHENE SULFONAMIDE-1, 1-DIOXIDE DERIVATIVES AND THEIR USE AS ANTINEOPLASTIC AGENTS | UNIVERSIDAD PUBLICA DE NAVARRA (ES) | 2000-10-26 | — | — | WO | disclosed |