Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALPG | P10696 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL4631294 | 1.00 | TSHR (0.48) | TSHRCES2CES1ESR1ESR2 | |
| SCHEMBL16258183 | 0.82 | TSHR (0.44) | TSHRCES2CES1ESR1ESR2 | |
| SCHEMBL4062640 | 0.82 | TSHR (0.44) | TSHRCES2CES1ESR1ESR2 | |
| SCHEMBL7205406 | 0.79 | CES2 (0.46) | TSHRCES2CES1ESR1ESR2 | |
| SCHEMBL3718088 | 0.77 | CES2 (0.39) | CES2CES1ESR1ESR2SMN1; SMN2 | |
| SCHEMBL11030008 | 0.76 | PDE2A (0.41) | TSHR | |
| SCHEMBL6908022 | 0.76 | TSHR (0.60) | TSHRESR1ESR2SMN1; SMN2ALDH1A1 | |
| SCHEMBL199580 | 0.76 | TSHR (0.60) | TSHRESR1ESR2SMN1; SMN2ALDH1A1 | |
| SCHEMBL16951204 | 0.75 | CES2 (0.38) | CES2CES1ESR1ESR2SMN1; SMN2 | |
| SCHEMBL5660658 | 0.75 | CES2 (0.38) | CES2CES1ESR1ESR2SMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0957083-B1 | Process for stabilising cyanhydrines | DSM FINE CHEM AUSTRIA GMBH (AT) | 2002-04-10 | — | — | EP | claimed |
| US-6031123-A | Process for stabilizing cyanohydrins | DSM FINE CHEMICALS AUSTRIA GMBH (AT) | 2000-02-29 | — | — | US | claimed |
| US-6417377-B1 | Process for preparing enantiomer-enriched amino- and hydroxyfuranones | DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) | 2002-07-09 | — | — | US | disclosed |
| US-6225095-B1 | REACTING ALDEHYDE OR KETONE DISSOLVED IN AN ORGANIC, WATER-IMMISCIBLE OR SLIGHTLY MISCIBLE DILUENT, AN AQUEOUS HYDROXYNITRILE LYASE SOLUTION, AND A CYANIDE GROUP DONOR TO FORM AN EMULSION WHICH IS MAINTAINED BY STIRRING | DSM FINE CHEMICALS AUSTRIA GMBH (AT) | 2001-05-01 | — | — | US | disclosed |
| US-6031123-A | Process for stabilizing cyanohydrins | DSM FINE CHEMICALS AUSTRIA GMBH (AT) | 2000-02-29 | — | — | US | disclosed |