Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.48 |
| ▸ | CA12 | O43570 | 6/20 | 0.48 |
| ▸ | CA1 | P00915 | 6/20 | 0.48 |
| ▸ | CA9 | Q16790 | 6/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | OGA | O60502 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL20068297 | 1.00 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL26500775 | 1.00 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL8431814 | 1.00 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL8431811 | 1.00 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL13663076 | 1.00 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL26445085 | 1.00 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL7150751 | 0.91 | CA2 (0.46) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL26094502 | 0.90 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL26445123 | 0.90 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 | |
| SCHEMBL26442183 | 0.90 | CA2 (0.48) | CA2CA12CA1CA9CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3819303-A1 | GLYCOSIDE COMPOUND AND PREPARATION METHOD THEREFOR, COMPOSITION, APPLICATION, AND INTERMEDIATE | Shanghai Hutchison Pharmaceuticals Limited (CN) | 2021-05-12 | — | — | EP | disclosed |
| US-9687686-B2 | Siloxane-containing fire extinguishing foam | UNIVERSITÄT ZU KÖLN (DE) | 2017-06-27 | — | — | US | disclosed |
| US-4171356-A | 2-Unsubstituted derivatives of 4,6-di-o-(aminoglycosyl)-1,3-diaminocyclitois, methods for their use as antibacterial agents and compositions useful therefor | SCHERING CORPORATION (US) | 1979-10-16 | — | — | US | disclosed |