Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 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 | |
|---|---|---|---|---|
| SCHEMBL2641075 | 0.82 | ABCB11 (0.52) | ABCB11TRPA1ESR1ESR2CYP2C9 | |
| SCHEMBL2491902 | 0.79 | TYR (0.34) | ESR1ESR2TYRGRIA4TAAR1 | |
| SCHEMBL220825 | 0.79 | ALDH1A1 (0.46) | ABCB11TRPA1ESR1ESR2TYR | |
| SCHEMBL2494634 | 0.76 | TYR (0.32) | TYRGRIA4 | |
| SCHEMBL6933308 | 0.75 | ABCB11 (0.47) | ABCB11TRPA1ESR1ESR2CYP2C9 | |
| SCHEMBL694439 | 0.75 | TYR (0.58) | TYRCYP2C9KDM4EMAPK1NPC1 | |
| SCHEMBL10396707 | 0.75 | ABCB11 (0.47) | ABCB11TRPA1ESR1ESR2TYR | |
| SCHEMBL10396706 | 0.75 | ABCB11 (0.47) | ABCB11TRPA1ESR1ESR2TYR | |
| SCHEMBL9694221 | 0.75 | ABCB11 (0.47) | ABCB11TRPA1ESR1ESR2GRIA4 | |
| SCHEMBL2493056 | 0.73 | STAT3 (0.36) | TYRSTAT3KDM4EMAPK1ACHE |
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-1395622-B1 | ARBORESCENT THERMOPLASTIC ELASTOMERS AND PRODUCTS THEREFROM | AUSTIN VENTURE PARTNERS LLC (US) | 2011-10-05 | — | — | EP | claimed |