Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.39 |
| ▸ | CA2 | P00918 | 5/20 | 0.39 |
| ▸ | CA9 | Q16790 | 5/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PTGES | O14684 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11701964 | 0.84 | SLC40A1 (0.40) | CA12CA2CA9CA1CA4 | |
| SCHEMBL6796058 | 0.83 | CA12 (0.43) | CA12CA2CA9CA1CA4 | |
| Hydrochloric Acid SCHEMBL3809667 | 0.82 | CA12 (0.42) | CA12CA2CA9CA1CA4 | |
| SCHEMBL7190117 | 0.80 | CA12 (0.43) | CA12CA2CA9CA1CA4 | |
| SCHEMBL9848829 | 0.79 | CA12 (0.42) | CA12CA2CA9CA1CA4 | |
| SCHEMBL19138045 | 0.79 | PTGES (0.55) | CA12CA2CA9CA7LMNA | |
| SCHEMBL11002885 | 0.79 | CA12 (0.49) | CA12CA2CA9CA1CA4 | |
| SCHEMBL7973834 | 0.78 | SLC40A1 (0.40) | CA12CA2CA9CA1CA4 | |
| SCHEMBL10812986 | 0.76 | NPC1 (0.49) | KDM4EUSP2KMT2AALDH1A1PTGS2 | |
| Methane SCHEMBL11040703 | 0.75 | CA12 (0.39) | CA12CA2CA9CA1CA4 |
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-113527282-B | 1, 2-benzothiazine heterocyclic derivative and preparation method and application thereof | 齐鲁医药学院 | 2023-02-07 | — | — | CN | claimed |