Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.73 |
| ▸ | CA2 | P00918 | 2/20 | 0.73 |
| ▸ | CA7 | P43166 | 2/20 | 0.73 |
| ▸ | CA9 | Q16790 | 2/20 | 0.73 |
| ▸ | CA12 | O43570 | 1/20 | 0.73 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.73 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
| ▸ | CASP3 | P42574 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.61 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.61 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.61 |
| ▸ | APP | P05067 | 1/20 | 0.59 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 2/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL197522 | 0.97 | CA1 (0.79) | CA1CA2CA7CA9CA12 | |
| SCHEMBL6733562 | 0.97 | CA1 (0.79) | CA1CA2CA7CA9CA12 | |
| SCHEMBL9151672 | 0.97 | CA1 (0.79) | CA1CA2CA7CA9CA12 | |
| Methyl Alcohol SCHEMBL28098026 | 0.90 | ESR2 (0.75) | CA1CA2CA7CA9CA12 | |
| SCHEMBL7243101 | 0.89 | ESR2 (0.58) | CA1CA2CA7CA9CA12 | |
| SCHEMBL13038584 | 0.88 | LTA4H (0.67) | CA1CA2CA7CA9CA12 | |
| SCHEMBL7610770 | 0.88 | LTA4H (0.67) | CA1CA2CA7CA9CA12 | |
| SCHEMBL3743494 | 0.88 | ABL1 (0.71) | CA1CA2CA7CA9CA12 | |
| SCHEMBL920933 | 0.88 | ABL1 (0.71) | CA1CA2CA7CA9CA12 | |
| 1,4-Dimethoxybenzene SCHEMBL8489 | 0.86 | CA1 (1.00) | CA1CA2CA7CA9CA12 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112390697-B | Synthesis method of N-arylselenium/thioethyl sulfoxide imine | 成都理工大学 | 2023-03-10 | — | — | CN | claimed |
| CN-112390697-A | Synthesis method of N-arylselenium/thioethyl sulfoxide imine | 成都理工大学 | 2021-02-23 | — | — | CN | claimed |
| CN-118221642-A | Sulfonamide derivative and application thereof in medicine | 西藏海思科制药有限公司 | 2024-06-21 | — | — | CN | disclosed |
| CN-117924411-A | Method for thioimidization of amino acid or polypeptide carboxyl locus and application of method in preparation of antitumor polypeptide coupling medicine | 兰州大学 | 2024-04-26 | — | — | CN | disclosed |
| CN-117802511-A | Preparation method of thiosulfate compound | 西华大学 | 2024-04-02 | — | — | CN | disclosed |
| CN-116284676-A | High Jiang Zixiu complex ion gel and preparation method thereof | 东华大学 | 2023-06-23 | — | — | CN | disclosed |
| CN-109836364-B | Method for continuously producing aryl disulfide compound in pipeline manner | 浙江大学 | 2020-06-02 | — | — | CN | disclosed |