Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 6/20 | 0.80 |
| ▸ | CA12 | O43570 | 4/20 | 0.80 |
| ▸ | CA1 | P00915 | 4/20 | 0.80 |
| ▸ | CA2 | P00918 | 4/20 | 0.80 |
| ▸ | CA6 | P23280 | 4/20 | 0.80 |
| ▸ | CA5A | P35218 | 4/20 | 0.80 |
| ▸ | CA7 | P43166 | 4/20 | 0.80 |
| ▸ | CA9 | Q16790 | 4/20 | 0.80 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.80 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.80 |
| ▸ | HTR1A | P08908 | 1/20 | 0.80 |
| ▸ | CA4 | P22748 | 1/20 | 0.80 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.80 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.80 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.80 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.80 |
| ▸ | APP | P05067 | 9/20 | 0.67 |
| ▸ | AQP1 | P29972 | 1/20 | 0.57 |
| ▸ | TEX264 | Q9Y6I9 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL16380456 | 0.90 | CA12 (0.82) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL229073 | 0.90 | CA12 (0.85) | CISD1CA12CA1CA2CA6 | |
| Furosemide SCHEMBL27537915 | 0.89 | CISD1 (0.92) | CISD1CA12CA1CA2CA6 | |
| Furosemide SCHEMBL29406913 | 0.89 | CISD1 (1.00) | CISD1CA12CA1CA2CA6 | |
| Furosemide SCHEMBL9811 | 0.89 | CISD1 (1.00) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL2880956 | 0.89 | CA12 (0.83) | CISD1CA12CA1CA2CA6 | |
| Furosemide SCHEMBL428921 | 0.89 | CISD1 (1.00) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL28793862 | 0.89 | CISD1 (0.73) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL29436031 | 0.89 | CA12 (0.76) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL13543257 | 0.88 | CA12 (0.78) | CISD1CA12CA1CA2CA6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7645771-B2 | CCR5 antagonists as therapeutic agents | SMITHKLINE BEECHAM CORP. (US) | 2010-01-12 | — | — | US | disclosed |