Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 10/20 | 0.46 |
| ▸ | CA1 | P00915 | 10/20 | 0.46 |
| ▸ | CA2 | P00918 | 10/20 | 0.46 |
| ▸ | CA9 | Q16790 | 10/20 | 0.46 |
| ▸ | CA7 | P43166 | 5/20 | 0.46 |
| ▸ | CA4 | P22748 | 2/20 | 0.46 |
| ▸ | CA5A | P35218 | 2/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.46 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5173136 | 0.83 | ALDH1A1 (0.36) | CA12CA2LMNAHSD17B10ALDH1A1 | |
| SCHEMBL30999657 | 0.79 | METAP2 (0.45) | CA12CA2POLBLMNAHSD17B10 | |
| SCHEMBL28372998 | 0.79 | METAP2 (0.45) | CA12CA2POLBLMNAHSD17B10 | |
| SCHEMBL3165386 | 0.72 | ALDH1A1 (0.39) | CA12CA1CA2CA9LMNA | |
| SCHEMBL2591217 | 0.71 | ALDH1A1 (0.38) | CA12CA1CA2CA9LMNA | |
| SCHEMBL27809409 | 0.69 | ALDH1A1 (0.37) | POLBLMNAHSD17B10ALDH1A1KDM4E | |
| Benzenesulfonamide SCHEMBL28194516 | 0.68 | CA2 (0.89) | CA12CA1CA2CA9CA7 | |
| SCHEMBL11022160 | 0.68 | CA2 (0.41) | CA12CA1CA2CA9CA7 | |
| Benzenesulfonamide SCHEMBL6868390 | 0.68 | CA2 (1.00) | CA12CA1CA2CA9CA7 | |
| Benzenesulfonamide SCHEMBL729 | 0.68 | CA2 (1.00) | CA12CA1CA2CA9CA7 |
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-104540822-B | Crystal formation of dabrafenib mesylate and preparation method thereof | 杭州普晒医药科技有限公司 | 2016-08-31 | — | — | CN | disclosed |