Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL272407 | 1.00 | APLNR (0.45) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL5883941 | 0.79 | APLNR (0.67) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3778963 | 0.79 | APLNR (0.48) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3828406 | 0.79 | APLNR (0.45) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL532643 | 0.76 | APLNR (0.47) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3825088 | 0.75 | APLNR (0.45) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3824303 | 0.75 | APLNR (0.45) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3824309 | 0.75 | APLNR (0.45) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3825092 | 0.75 | APLNR (0.45) | APLNRALDH1A1LMNANR1I2ABCB11 | |
| SCHEMBL3129361 | 0.73 | APLNR (0.46) | APLNRALDH1A1LMNANR1I2ABCB11 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8133856-B2 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2012-03-13 | — | — | US | claimed |
| EP-1648526-B1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | SYMRISE GMBH & CO KG (DE) | 2009-09-09 | — | — | EP | claimed |
| US-20060211597-A1 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2006-09-21 | — | — | US | claimed |
| EP-1648526-A1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | Symrise GmbH & Co. KG (DE) | 2006-04-26 | — | — | EP | claimed |
| WO-2005009492-A1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | SYMRISE GMBH & CO. KG (DE) | 2005-02-03 | — | — | WO | claimed |
| US-8133856-B2 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2012-03-13 | — | — | US | disclosed |
| EP-1648526-B1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | SYMRISE GMBH & CO KG (DE) | 2009-09-09 | — | — | EP | disclosed |
| US-20060211597-A1 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2006-09-21 | — | — | US | disclosed |
| EP-1648526-A1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | Symrise GmbH & Co. KG (DE) | 2006-04-26 | — | — | EP | disclosed |
| WO-2005009492-A1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | SYMRISE GMBH & CO. KG (DE) | 2005-02-03 | — | — | WO | disclosed |