Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.95 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.95 |
| ▸ | CA2 | P00918 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL1353453 | 1.00 | GABRA1 (0.95) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL56224 | 0.98 | GABRA1 (1.00) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL29407049 | 0.98 | GABRA1 (1.00) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL28297717 | 0.95 | GABRA1 (0.95) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL28255130 | 0.95 | GABRA1 (0.95) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL28119496 | 0.95 | GABRA1 (0.95) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL28015936 | 0.95 | GABRA1 (0.95) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| Hydrochloric Acid SCHEMBL7034786 | 0.93 | GABRA1 (0.91) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| SCHEMBL28525558 | 0.91 | GABRA1 (0.88) | GABRA1GABRB2CA2ALDH1A1TRPA1 | |
| Sulfur Dioxide SCHEMBL28519364 | 0.90 | GABRA1 (0.84) | GABRA1GABRB2CA2ALDH1A1TRPA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105916950-A | Rosin ester and composition thereof | 阿利桑那化学公司 | 2016-08-31 | — | — | CN | disclosed |
| CN-105916949-A | Rosin esters and compositions thereof | 阿利桑那化学公司 | 2016-08-31 | — | — | CN | disclosed |
| CN-105658750-A | Methods of making rosin esters | 阿利桑那化学公司 | 2016-06-08 | — | — | CN | disclosed |