Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.45 |
| ▸ | RXRA | P19793 | 2/20 | 0.38 |
| ▸ | RXRG | P48443 | 2/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HK1 | P19367 | 1/20 | 0.34 |
| ▸ | HK2 | P52789 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16772118 | 0.89 | KIF11 (0.57) | KIF11PTGDR2RXFP1CYP3A4CYP3A5 | |
| SCHEMBL16771997 | 0.87 | RXRA (0.39) | KIF11RXRARXRGRXRBPTGDR2 | |
| SCHEMBL16771993 | 0.85 | RXFP1 (0.41) | KIF11RXRARXRGPTGDR2TMPRSS4 | |
| SCHEMBL16771984 | 0.85 | CES2 (0.40) | RXRARXRGRXRBGSK3B | |
| SCHEMBL16772010 | 0.76 | TAS2R14 (0.38) | PTPN5 | |
| SCHEMBL16772042 | 0.75 | RPS6KA3 (0.33) | RXRARXRGRXRBGSK3B | |
| SCHEMBL16771999 | 0.75 | AKR1C3 (0.33) | RXRARXRGRXRB | |
| SCHEMBL16772075 | 0.74 | RXRA (0.45) | KIF11RXRARXRGRXRBPTGDR2 | |
| SCHEMBL16772041 | 0.74 | CTSS (0.33) | — | |
| SCHEMBL16772104 | 0.74 | CYP11B2 (0.48) | — |
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 |