Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | IDE | P14735 | 1/20 | 0.36 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2112972 | 0.89 | COMT (0.49) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| SCHEMBL29564068 | 0.89 | COMT (0.49) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| Hydrochloric Acid SCHEMBL28205807 | 0.76 | COMT (0.50) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| SCHEMBL4660499 | 0.71 | COMT (0.50) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| SCHEMBL7867326 | 0.70 | COMT (0.53) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| SCHEMBL9002773 | 0.70 | COMT (0.49) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| SCHEMBL28502273 | 0.70 | NFE2L2 (0.43) | COMTNAPRTKDM4EALOX12HTT | |
| SCHEMBL7081072 | 0.70 | KDM4E (0.53) | COMTALDH1A1CYP1A2HIF1AALOX15 | |
| Pyrrole SCHEMBL28855331 | 0.69 | MYC (0.44) | ALDH1A1MEN1POLBKMT2AKDM4E | |
| SCHEMBL3717899 | 0.69 | COMT (0.41) | COMTALDH1A1CYP1A2HIF1AALOX15 |
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-106029740-B | For improving the additive of the rheological characteristic of inorganic adhesive | 建筑研究和技术有限公司 | 2018-12-25 | — | — | CN | disclosed |
| CN-108699233-A | Water-reducing agent based on condensation polymer | 建筑研究和技术有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-106029740-A | Additive for rheology improvement of inorganic binders | 建筑研究和技术有限公司 | 2016-10-12 | — | — | CN | disclosed |