Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | MGAM | O43451 | 1/20 | 0.56 |
| ▸ | SI | P14410 | 1/20 | 0.56 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | DGKA | P23743 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.48 |
| ▸ | PAM | P19021 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9958801 | 1.00 | GAA (0.56) | GAAMGAMSIMGAM2CYP1A2 | |
| SCHEMBL6138808 | 0.98 | GAA (0.58) | GAAMGAMSIMGAM2CYP1A2 | |
| SCHEMBL4476235 | 0.96 | GAA (0.61) | GAAMGAMSIMGAM2CYP1A2 | |
| SCHEMBL6303688 | 0.96 | GAA (0.61) | GAAMGAMSIMGAM2CYP1A2 | |
| SCHEMBL1223746 | 0.94 | GAA (0.58) | GAAMGAMSIMGAM2CYP1A2 | |
| SCHEMBL19127030 | 0.92 | TSHR (0.52) | GAAMGAMSIMGAM2CYP1A2 | |
| SCHEMBL3777425 | 0.90 | HAO1 (0.55) | GAAMGAMSIMGAM2DGKA | |
| SCHEMBL6138705 | 0.90 | HAO1 (0.55) | GAAMGAMSIMGAM2DGKA | |
| SCHEMBL6138882 | 0.90 | HAO1 (0.55) | GAAMGAMSIMGAM2DGKA | |
| SCHEMBL3442509 | 0.90 | HAO1 (0.55) | GAAMGAMSIMGAM2DGKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105646211-A | Synthesis method of rosuvastatin medicament intermediate cetonedicarboxylic acid diethyl ester | 成都东电艾尔科技有限公司 | 2016-06-08 | — | — | CN | disclosed |
| CN-105646211-A | Synthesis method of rosuvastatin medicament intermediate cetonedicarboxylic acid diethyl ester | 成都东电艾尔科技有限公司 | 2016-06-08 | — | — | CN | disclosed |