Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL317177 | 0.81 | GAA (0.33) | CYP2D6TSHRCYP2C19HIF1AKDM4E | |
| SCHEMBL5465237 | 0.74 | GAA (0.39) | KDM4EGAAL3MBTL1ALDH1A1ALOX15 | |
| SCHEMBL5448838 | 0.72 | MEN1 (0.33) | GAAL3MBTL1ALDH1A1 | |
| Citric Acid SCHEMBL986838 | 0.72 | ALDH1A1 (0.48) | CYP2D6TSHRCYP2C19HIF1AKDM4E | |
| Citric Acid SCHEMBL985329 | 0.72 | ALDH1A1 (0.48) | CYP2D6TSHRCYP2C19HIF1AKDM4E | |
| Citric Acid SCHEMBL986854 | 0.72 | ALDH1A1 (0.48) | CYP2D6TSHRCYP2C19HIF1AKDM4E | |
| SCHEMBL7509065 | 0.72 | — | — | |
| SCHEMBL7511786 | 0.71 | GAA (0.33) | KDM4EGAAL3MBTL1ALDH1A1ALOX15 | |
| Citric Acid SCHEMBL7531324 | 0.71 | ALDH1A1 (0.47) | CYP2D6TSHRKDM4EGAAL3MBTL1 | |
| SCHEMBL316373 | 0.70 | GAA (0.30) | GAAL3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1095006-B1 | DERIVATIVES OF 1-OXYL-4-HYDROXY-2,2,6,6-TETRAMETHYLPIPERIDINE AS POLYMERIZATION INHIBITORS FOR (METH) ACRYLATE MONOMERS | CIBA HOLDING INC (CH) | 2008-12-24 | — | — | EP | claimed |