Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.52 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.46 |
| ▸ | HNF4A | P41235 | 3/20 | 0.46 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23521242 | 0.89 | FOLH1 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31095720 | 0.86 | HSD17B10 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29420726 | 0.86 | HSD17B10 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27718034 | 0.86 | HNF4A (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5590480 | 0.86 | HNF4A (0.48) | CA12CA1CA2CA7CA9 | |
| SCHEMBL21879681 | 0.85 | CDC25B (0.50) | ALDH1A1HPGDBCL2L1FOLH1HNF4A | |
| SCHEMBL11900978 | 0.84 | CA12 (0.48) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8747589 | 0.84 | CA12 (0.48) | CA12CA1CA2CA7CA9 | |
| Hydrochloric Acid SCHEMBL27739302 | 0.84 | HNF4A (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL3264678 | 0.83 | CA12 (0.64) | CA12CA1CA2CA7CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111359668-A | Preparation method of metal organic framework single-site catalyst for simulating peroxidase | 浙江大学 | 2020-07-03 | — | — | CN | claimed |
| CN-111359668-A | Preparation method of metal organic framework single-site catalyst for simulating peroxidase | 浙江大学 | 2020-07-03 | — | — | CN | disclosed |