Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 12/20 | 0.57 |
| ▸ | CA1 | P00915 | 11/20 | 0.57 |
| ▸ | CA9 | Q16790 | 11/20 | 0.57 |
| ▸ | CA12 | O43570 | 10/20 | 0.57 |
| ▸ | CA4 | P22748 | 3/20 | 0.57 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.57 |
| ▸ | CA3 | P07451 | 2/20 | 0.57 |
| ▸ | CA6 | P23280 | 2/20 | 0.57 |
| ▸ | CA5A | P35218 | 2/20 | 0.57 |
| ▸ | CA7 | P43166 | 2/20 | 0.57 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.57 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.50 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL393905 | 0.85 | TDP1 (0.61) | CA2CA1CA9CA12CA4 | |
| Benzenesulfonamide SCHEMBL28333617 | 0.83 | CA2 (0.67) | CA2CA1CA9CA12CA4 | |
| Lithium SCHEMBL31621904 | 0.83 | TDP1 (0.59) | CA2CA1CA9CA12CA4 | |
| Ammonia Solution, Strong SCHEMBL28392198 | 0.83 | TDP1 (0.59) | CA2CA1CA9CA12CA4 | |
| SCHEMBL9492465 | 0.83 | TDP1 (0.59) | CA2CA1CA9CA12CA4 | |
| SCHEMBL28286695 | 0.83 | TDP1 (0.59) | CA2CA1CA9CA12CA4 | |
| Sulfanilamide SCHEMBL27569794 | 0.81 | CA2 (0.61) | CA2CA1CA9CA12CA4 | |
| SCHEMBL10585650 | 0.80 | TDP1 (0.81) | CA2CA1CA9CA12CA4 | |
| P-Chlorobenzenesulfonamide SCHEMBL7527510 | 0.79 | CA12 (0.82) | CA2CA1CA9CA12CA4 | |
| P-Chlorobenzenesulfonamide SCHEMBL28326001 | 0.79 | CA12 (0.90) | CA2CA1CA9CA12CA4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109761944-A | A kind of chrysin amide derivatives and preparation method thereof and medical usage | 武汉翼博济生生物科技有限公司 | 2019-05-17 | — | — | CN | disclosed |