Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CETP | P11597 | 1/20 | 0.47 |
| ▸ | PTGES | O14684 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | ACE | P12821 | 1/20 | 0.45 |
| ▸ | CPA1 | P15085 | 1/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9734389 | 0.83 | IDO1 (0.38) | — | |
| SCHEMBL12549624 | 0.81 | TSHR (0.46) | ALDH1A1TSHR | |
| SCHEMBL92279 | 0.81 | TSHR (0.46) | ALDH1A1TSHR | |
| SCHEMBL14310474 | 0.81 | TSHR (0.46) | ALDH1A1TSHR | |
| SCHEMBL7922580 | 0.80 | CETP (0.46) | FFAR1KDM4EALDH1A1TDP1CETP | |
| SCHEMBL13184971 | 0.77 | IDO1 (0.55) | FFAR1ALDH1A1TACR1 | |
| SCHEMBL10799979 | 0.76 | FFAR1 (0.53) | FFAR1KDM4EALDH1A1TDP1CETP | |
| SCHEMBL11214943 | 0.76 | MMP1 (0.47) | FFAR1TDP1CETPPTGESMME | |
| SCHEMBL2093737 | 0.76 | KDM4E (0.55) | FFAR1KDM4EALDH1A1TDP1CETP | |
| SCHEMBL9558340 | 0.76 | PTGES (0.47) | FFAR1KDM4EALDH1A1TDP1CETP |
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 |