Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3844562 | 0.97 | CA1 (0.42) | CA1CA2CA9CA12ALDH1A1 | |
| Bromide SCHEMBL20985008 | 0.97 | CA1 (0.42) | CA1CA2CA9CA12 | |
| Phosphoric Acid SCHEMBL20984431 | 0.86 | CA1 (0.40) | CA1CA2CA9CA12 | |
| Oxalic Acid SCHEMBL20985013 | 0.86 | CA1 (0.40) | CA1CA2CA9CA12ALDH1A1 | |
| Sulfuric Acid SCHEMBL20984727 | 0.86 | CA1 (0.48) | CA1CA2CA9CA12 | |
| Nitric Acid SCHEMBL20984387 | 0.82 | CA1 (0.42) | CA1CA2CA9CA12ALDH1A1 | |
| SCHEMBL24190192 | 0.79 | CA1 (0.38) | CA1CA2CA9ALDH1A1TDP1 | |
| SCHEMBL3234702 | 0.79 | CA1 (0.42) | CA1CA2CA9 | |
| SCHEMBL13496828 | 0.79 | CA1 (0.38) | CA1CA2CA9 | |
| SCHEMBL22965640 | 0.78 | PIM1 (0.38) | CA1CA2CA9ALDH1A1 |
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-107663161-A | A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt | 上海惠和化德生物科技有限公司 | 2018-02-06 | — | — | CN | disclosed |
| WO-2013096744-A1 | HEPATITIS B ANTIVIRAL AGENTS | NOVIRA THERAPEUTICS, INC. (US) | 2013-06-27 | — | — | WO | disclosed |
| CN-101573339-A | Novel cannabinoid receptor ligands, pharmaceutical compositions containing them, and processes for their preparation | GLENMARK PHARMACEUTICALS SA (CH) | 2009-11-04 | — | — | CN | disclosed |