Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.57 |
| ▸ | CA9 | Q16790 | 5/20 | 0.57 |
| ▸ | CA1 | P00915 | 5/20 | 0.57 |
| ▸ | CA12 | O43570 | 4/20 | 0.57 |
| ▸ | CA6 | P23280 | 3/20 | 0.57 |
| ▸ | CA5A | P35218 | 2/20 | 0.57 |
| ▸ | CA7 | P43166 | 2/20 | 0.57 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.57 |
| ▸ | CA3 | P07451 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31000980 | 0.90 | GAA (0.68) | CA2CA9CA1CA12CA6 | |
| SCHEMBL11853033 | 0.90 | GAA (0.68) | CA2CA9CA1CA12CA6 | |
| SCHEMBL29469862 | 0.84 | HTR6 (0.63) | CA2CA9CA1CA12CA6 | |
| SCHEMBL794103 | 0.84 | HTR6 (0.63) | CA2CA9CA1CA12CA6 | |
| SCHEMBL11496596 | 0.83 | CA2 (0.55) | CA2CA9CA1CA12CA6 | |
| SCHEMBL11779771 | 0.82 | HTR6 (0.61) | CA2CA9CA1CA12CA6 | |
| Hydrochloric Acid SCHEMBL4616714 | 0.82 | HTR6 (0.61) | CA2CA9CA1CA12CA6 | |
| SCHEMBL29155810 | 0.82 | HTR6 (0.61) | CA2CA9CA1CA12CA6 | |
| SCHEMBL30564946 | 0.82 | HTR6 (0.61) | CA2CA9CA1CA12CA6 | |
| SCHEMBL9388942 | 0.81 | GAA (0.56) | CA2CA9CA1CA12CA6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112002943-B | Electrolyte and preparation method and application thereof | 中国科学院过程工程研究所 | 2022-05-17 | — | — | CN | disclosed |
| CN-112002943-A | Electrolyte and preparation method and application thereof | 中国科学院过程工程研究所 | 2020-11-27 | — | — | CN | disclosed |
| WO-2012160112-A1 | NOVEL IODINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND USE THEREOF AS AMINATION AGENTS | FUNDACIÓ PRIVADA INSTITUT CATALÀ D'INVESTIGACIÓ QUÍMICA (ICIQ) (ES) | 2012-11-29 | — | — | WO | disclosed |