Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL2422951 | 0.85 | TSHR (0.36) | TSHRCYP2D6CYP2C19HIF1AHMGCR | |
| SCHEMBL2423577 | 0.77 | PAM (0.37) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL2423483 | 0.75 | PAM (0.39) | GAATSHRALDH1A1 | |
| SCHEMBL21812161 | 0.74 | GAA (0.44) | GAAMGAMSIMGAM2TSHR | |
| SCHEMBL62453 | 0.72 | CYP2C19 (0.44) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL5607319 | 0.72 | GAA (0.50) | GAAMGAMSIMGAM2TSHR | |
| SCHEMBL2420818 | 0.71 | ACLY (0.37) | GAAMGAMSIMGAM2TSHR | |
| SCHEMBL2208416 | 0.70 | GAA (0.48) | GAAMGAMSIMGAM2TSHR | |
| SCHEMBL1607153 | 0.70 | GAA (0.48) | GAAMGAMSIMGAM2TSHR | |
| SCHEMBL7841654 | 0.69 | GAA (0.46) | GAAMGAMSIMGAM2TSHR |
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-1491523-B1 | ESTER COMPOUND, PLASTICIZER FOR BIODEGRADABLE ALIPHATIC POLYESTER RESIN, AND BIODEGRADABLE RESIN COMPOSITION | DAIHACHI CHEM IND (JP) | 2011-09-14 | — | — | EP | claimed |