Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 4/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.32 |
| ▸ | FDPS | P14324 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Citronellyl Acetate SCHEMBL4623480 | 0.92 | ALOX15 (0.87) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| Formic Acid SCHEMBL17748814 | 0.85 | ALOX15 (0.65) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| Citronellyl Acetate SCHEMBL157075 | 0.85 | ALOX15 (1.00) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| SCHEMBL416782 | 0.85 | ALOX15 (0.64) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| Citronellyl Acetate SCHEMBL20912959 | 0.85 | ALOX15 (1.00) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| SCHEMBL23832186 | 0.85 | ALOX15 (0.64) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| Citronellyl Acetate SCHEMBL1866109 | 0.85 | ALOX15 (1.00) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| SCHEMBL1871307 | 0.85 | ALOX15 (0.64) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| SCHEMBL22498579 | 0.85 | ALOX15 (0.65) | ALOX15ALDH1A1EPHX2NFE2L2USP2 | |
| SCHEMBL4950090 | 0.84 | ALOX15 (0.61) | ALOX15ALDH1A1TSHRPTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2242498-A2 | SYNERGISTIC ANTIPARASITIC COMPOSITIONS AND SCREENING METHODS | Tyratech, Inc. (US) | 2010-10-27 | — | — | EP | disclosed |
| WO-2009086471-A2 | SYNERGISTIC ANTIPARASITIC COMPOSITIONS AND SCREENING METHODS | TYRATECH, INC. (US) | 2009-07-09 | — | — | WO | disclosed |