Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | AR | P10275 | 5/20 | 0.34 |
| ▸ | EDNRB | P24530 | 1/20 | 0.33 |
| ▸ | EDNRA | P25101 | 1/20 | 0.33 |
| ▸ | POLQ | O75417 | 1/20 | 0.32 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.32 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
| ▸ | FLT1 | P17948 | 1/20 | 0.30 |
| ▸ | FLT4 | P35916 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.30 |
| ▸ | ESRRA | P11474 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16772037 | 0.81 | BACE1 (0.49) | CES2BACE1 | |
| SCHEMBL16769520 | 0.79 | PTPN11 (0.42) | CES2EDNRBEDNRAABCC8KCNJ11 | |
| SCHEMBL16772055 | 0.73 | CES2 (0.42) | CES2AREDNRBEDNRAPOLQ | |
| SCHEMBL10075607 | 0.68 | EDNRB (0.42) | CES2AREDNRBEDNRAPOLQ | |
| SCHEMBL16772093 | 0.67 | — | — | |
| SCHEMBL28676412 | 0.66 | TSHR (0.56) | CES2AREDNRBEDNRAABCC8 | |
| SCHEMBL13302009 | 0.65 | MAPT (0.45) | CES2ALDH1A1TDP2 | |
| SCHEMBL11588370 | 0.65 | HPRT1 (0.39) | CES2ARPOLQALDH1A1ESRRA | |
| SCHEMBL16772040 | 0.64 | CES2 (0.42) | CES2ARPOLQALDH1A1HTT | |
| SCHEMBL24397228 | 0.64 | TDP2 (0.40) | CES2TDP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20150155490-A1 | ORGANIC COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME | LG DISPLAY CO., LTD. (KR) | 2015-06-04 | — | — | US | disclosed |