Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 16/20 | 0.56 |
| ▸ | CA2 | P00918 | 16/20 | 0.56 |
| ▸ | CA12 | O43570 | 14/20 | 0.56 |
| ▸ | CA9 | Q16790 | 14/20 | 0.56 |
| ▸ | CA7 | P43166 | 3/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
| ▸ | CA5A | P35218 | 2/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
| ▸ | COMT | P21964 | 2/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.50 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.50 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29179024 | 0.81 | CA1 (0.53) | CA1CA2CA12CA9CA7 | |
| SCHEMBL29179059 | 0.81 | CA1 (0.53) | CA1CA2CA12CA9CA7 | |
| SCHEMBL3422896 | 0.70 | CA2 (0.54) | CA1CA2CA12CA9CA7 | |
| SCHEMBL10079423 | 0.70 | KDM4E (0.53) | CA1CA2CA12CA9CA7 | |
| SCHEMBL2771870 | 0.69 | CA2 (0.56) | CA1CA2CA12CA9CA7 | |
| Benzenesulfonamide SCHEMBL729 | 0.69 | CA2 (1.00) | CA1CA2CA12CA9CA7 | |
| Benzenesulfonamide SCHEMBL6868390 | 0.69 | CA2 (1.00) | CA1CA2CA12CA9CA7 | |
| SCHEMBL19479299 | 0.69 | CA2 (1.00) | CA1CA2CA12CA9CA7 | |
| Benzenesulfonamide SCHEMBL1332409 | 0.69 | CA2 (1.00) | CA1CA2CA12CA9CA7 | |
| Benzenesulfonamide SCHEMBL29825137 | 0.69 | CA2 (1.00) | CA1CA2CA12CA9CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2697197-A1 | PYRROLO SULFONAMIDE COMPOUNDS FOR MODULATION OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORGAMMA, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES | Phenex Pharmaceuticals AG (DE) | 2014-02-19 | — | — | EP | disclosed |
| WO-2012139775-A1 | PYRROLO SULFONAMIDE COMPOUNDS FOR MODULATION OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORGAMMA, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES | PHENEX PHARMACEUTICALS AG (DE) | 2012-10-18 | — | — | WO | disclosed |