Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9417859 | 0.86 | ALOX5 (0.46) | PPARACNR2HTTCYP3A4TSHR | |
| SCHEMBL9417840 | 0.86 | NR1H4 (0.50) | NR1H4SMN1; SMN2L3MBTL1MAPK1CNR2 | |
| SCHEMBL9417761 | 0.85 | NR1H4 (0.42) | NR1H4PPARALMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL9417817 | 0.85 | NR1H4 (0.52) | NR1H4SMN1; SMN2CNR2CNR1HTT | |
| SCHEMBL9417812 | 0.85 | NR1H4 (0.52) | NR1H4SMN1; SMN2CNR2CNR1HTT | |
| SCHEMBL9417950 | 0.85 | NR1H4 (0.52) | NR1H4SMN1; SMN2CNR2CNR1HTT | |
| SCHEMBL9417983 | 0.83 | LTB4R (0.50) | NR1H4SMN1; SMN2CNR2CNR1HTT | |
| SCHEMBL9417934 | 0.78 | PTPN1 (0.52) | SMN1; SMN2HTTCYP3A4 | |
| SCHEMBL16482745 | 0.77 | CYP3A4 (0.56) | NR1H4LMNAL3MBTL1MAPTCYP3A4 | |
| SCHEMBL9417878 | 0.76 | ALOX5 (0.52) | PPARACYP3A4TSHR |
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-5098613-A | Aromatic ethers for treatment of mammals | ELI LILLY AND COMPANY (US) | 1992-03-24 | — | — | US | disclosed |