Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.55 |
| ▸ | NAAA | Q02083 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | SMYD3 | Q9H7B4 | 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 | |
|---|---|---|---|---|
| SCHEMBL10681846 | 0.94 | CYP19A1 (0.51) | CYP19A1NAAACHRM2CHRM4CHRM1 | |
| SCHEMBL10707045 | 0.94 | CYP19A1 (0.51) | CYP19A1NAAACHRM2CHRM4CHRM1 | |
| SCHEMBL10677502 | 0.89 | CYP19A1 (0.48) | CYP19A1NAAACHRM2CHRM4CHRM1 | |
| SCHEMBL10677495 | 0.89 | CYP19A1 (0.48) | CYP19A1NAAACHRM2CHRM4CHRM1 | |
| SCHEMBL2253713 | 0.89 | — | — | |
| SCHEMBL21765657 | 0.89 | NAAA (0.48) | CYP19A1NAAACHRM2CHRM4CHRM1 | |
| Hydrochloric Acid SCHEMBL22466294 | 0.87 | — | — | |
| SCHEMBL4401621 | 0.86 | CYP19A1 (0.54) | CYP19A1NAAAEPHX1HTTMEN1 | |
| SCHEMBL4401626 | 0.86 | CYP19A1 (0.58) | CYP19A1NAAAEPHX1HTTMEN1 | |
| SCHEMBL5932281 | 0.84 | CYP19A1 (0.53) | CYP19A1NAAAEPHX1HTTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1447102-B1 | Cyclohexylethan-1-yl ester mixtures as malodour counteractants and methods for using same | INT FLAVORS & FRAGRANCES INC (US) | 2008-06-04 | — | — | EP | disclosed |