Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL4006078 | 0.92 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP2C9PPARAPPARG | |
| SCHEMBL29516499 | 0.92 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP2C9PPARAPPARG | |
| SCHEMBL10736299 | 0.85 | CYP3A4 (0.53) | CYP3A4CYP2D6CYP2C9HTR1AGABRA1 | |
| SCHEMBL3820757 | 0.83 | CYP3A4 (0.54) | CYP3A4CYP2D6CYP2C9HTR1AGABRA1 | |
| SCHEMBL29619878 | 0.83 | CYP3A4 (0.54) | CYP3A4CYP2D6CYP2C9HTR1AGABRA1 | |
| SCHEMBL31677053 | 0.80 | LIPG (0.51) | CYP3A4CYP2D6CYP2C9PPARAPPARG | |
| SCHEMBL17965857 | 0.80 | LIPG (0.51) | CYP3A4CYP2D6CYP2C9PPARAPPARG | |
| SCHEMBL2766194 | 0.79 | CYP3A4 (0.39) | CYP3A4CYP2D6CYP2C9PPARAPPARG | |
| SCHEMBL93143 | 0.79 | GABRA1 (0.50) | CYP3A4CYP2D6CYP2C9PPARAPPARG | |
| SCHEMBL2771239 | 0.79 | GABRA1 (0.48) | CYP3A4CYP2D6CYP2C9MIFPPARA |
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 |
|---|---|---|---|---|---|---|---|
| CN-109897351-A | A kind of preparation method of hydrolytic-resistant polylactic acid resin | 宿迁博古科技有限公司 | 2019-06-18 | — | — | CN | disclosed |