Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 6/20 | 0.53 |
| ▸ | NR1H2 | P55055 | 6/20 | 0.53 |
| ▸ | NR1H3 | Q13133 | 6/20 | 0.53 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.35 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3471876 | 0.88 | RXRA (0.53) | RXRANR1H2NR1H3 | |
| SCHEMBL3475014 | 0.82 | RXRA (0.56) | RXRANR1H2NR1H3NR3C2DGAT1 | |
| SCHEMBL3471163 | 0.82 | RXRA (0.56) | RXRANR1H2NR1H3NR3C2DGAT1 | |
| SCHEMBL3471878 | 0.82 | RXRA (0.51) | RXRANR1H2NR1H3NR3C2DGAT1 | |
| Tert-Butyl Formate SCHEMBL27738020 | 0.81 | RXRA (0.52) | RXRANR1H2NR1H3NR3C2TGFBR1 | |
| SCHEMBL3472699 | 0.74 | RXRA (0.66) | RXRANR1H2NR1H3NR3C2PTGS1 | |
| SCHEMBL3471289 | 0.74 | RXRA (0.68) | RXRANR1H2NR1H3NR3C2STIM1 | |
| SCHEMBL3473121 | 0.74 | RXRA (0.68) | RXRANR1H2NR1H3NR3C2PTGS1 | |
| SCHEMBL3471486 | 0.73 | RXRA (0.62) | RXRANR1H2NR1H3NR3C2 | |
| SCHEMBL3471616 | 0.73 | RXRA (0.57) | RXRANR1H2NR1H3NR3C2STIM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101248048-B | Imidazole based LXR modulators | EXELIXIS INC | 2013-08-28 | — | — | CN | disclosed |
| CN-101248048-A | Imidazole based LXR modulators | EXELIXIS INC (US) | 2008-08-20 | — | — | CN | disclosed |