Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.37 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.37 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.34 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.33 |
| ▸ | GLRB | P48167 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Cetostearyl Alcohol SCHEMBL28220384 | 0.89 | CYP1A2 (0.48) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL28025527 | 0.85 | CYP3A4 (0.50) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL7720160 | 0.84 | CYP3A4 (0.54) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL27993102 | 0.84 | CYP2C9 (0.52) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| Methane SCHEMBL8854369 | 0.83 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| Hydrazine SCHEMBL28202215 | 0.82 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| E968 SCHEMBL30522296 | 0.81 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL28034637 | 0.81 | CYP3A4 (0.41) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| Allyl Alcohol SCHEMBL28219123 | 0.80 | CYP1A2 (0.48) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL27949727 | 0.79 | NR1H4 (0.37) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR |
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-109762490-A | A kind of heat-insulated PVB film and preparation method thereof | 长春工业大学 | 2019-05-17 | — | — | CN | claimed |
| CN-109762490-A | A kind of heat-insulated PVB film and preparation method thereof | 长春工业大学 | 2019-05-17 | — | — | CN | disclosed |