Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 12/20 | 0.66 |
| ▸ | CA12 | O43570 | 7/20 | 0.66 |
| ▸ | CA1 | P00915 | 7/20 | 0.66 |
| ▸ | CA2 | P00918 | 7/20 | 0.66 |
| ▸ | CA9 | Q16790 | 7/20 | 0.66 |
| ▸ | CA4 | P22748 | 6/20 | 0.66 |
| ▸ | CA6 | P23280 | 6/20 | 0.66 |
| ▸ | CA7 | P43166 | 6/20 | 0.66 |
| ▸ | CA13 | Q8N1Q1 | 6/20 | 0.66 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.66 |
| ▸ | CA5B | Q9Y2D0 | 6/20 | 0.66 |
| ▸ | CA3 | P07451 | 5/20 | 0.66 |
| ▸ | CA5A | P35218 | 3/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8571767 | 0.86 | CISD1 (0.46) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL8574529 | 0.84 | CISD1 (0.45) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL8572624 | 0.84 | CISD1 (0.66) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL8576801 | 0.82 | CA1 (0.49) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL8574036 | 0.81 | ALDH1A1 (0.51) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL31717970 | 0.80 | CA12 (1.00) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL574023 | 0.80 | CA12 (1.00) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL11232241 | 0.78 | CISD1 (0.77) | CISD1CA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL11158505 | 0.78 | CA12 (0.96) | CISD1CA12CA1CA2CA9 | |
| SCHEMBL11198069 | 0.77 | CISD1 (0.74) | CISD1CA12CA1CA2CA9 |
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-5849796-A | Ortho-substituted benzoil acid derivatives | MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-15 | — | — | US | disclosed |