Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.57 |
| ▸ | CETP | P11597 | 1/20 | 0.56 |
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5199927 | 0.90 | CETP (0.52) | LTA4HCETPTSHRHSD17B10KDM4E | |
| SCHEMBL4734636 | 0.84 | IDO1 (0.57) | KDM4EALDH1A1TDP1L3MBTL1 | |
| SCHEMBL649009 | 0.83 | PLA2G4B (0.45) | NAAATSHRALDH1A1TDP1L3MBTL1 | |
| SCHEMBL2354114 | 0.83 | TSHR (0.56) | LTA4HCETPTSHRKDM4EALDH1A1 | |
| SCHEMBL9339485 | 0.82 | LTA4H (0.55) | LTA4HCETPFFAR1FFAR4 | |
| SCHEMBL317686 | 0.81 | TSHR (0.58) | LTA4HCETPNAAATSHRALDH1A1 | |
| Diphenylether SCHEMBL8929848 | 0.81 | LTA4H (0.77) | LTA4HTSHRALDH1A1HTT | |
| SCHEMBL9645040 | 0.81 | FFAR1 (0.46) | CETPNAAATSHRHSD17B10KDM4E | |
| SCHEMBL7922581 | 0.81 | NAAA (0.43) | CETPNAAAFFAR1FFAR4 | |
| SCHEMBL6795855 | 0.80 | LTA4H (0.55) | LTA4HCETPTSHRHSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001042196-A1 | ESTER COMPOUNDS, INTERMEDIATES FOR THE ESTER COMPOUNDS AND PESTICIDAL METHODS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-06-14 | — | — | WO | disclosed |
| US-RE37087-E1 | 1-(4-ETHOXYPHENYL)-4-(4-FLUORO-3-PHENOXYPHENYL)-1 -TRIFLUOROMETHYLBUTANE OR 1-(4-ETHOXY-3-FLUOROPHENYL)-4-(3-PHENOXYPHENYL)-1-TRIFLUOROMETHYLBUTANE, FOR EXAMPLE; COMBATS INSECTS AND MITES | SCHERING AKTIENGESELLSCHAFT (DE) | 2001-03-06 | — | — | US | disclosed |