Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 11/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 11/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 9/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 9/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11237665 | 1.00 | CHRNB2 (0.47) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL4419961 | 1.00 | CHRNB2 (0.47) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL15512506 | 0.92 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL11798845 | 0.92 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL15499934 | 0.92 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL16435305 | 0.92 | CHRNB2 (0.42) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| Hydrochloric Acid SCHEMBL15512319 | 0.91 | HCAR2 (0.46) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| Hydrochloric Acid SCHEMBL15512320 | 0.91 | HCAR2 (0.46) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL25623799 | 0.87 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR | |
| SCHEMBL373261 | 0.83 | TSHR (0.64) | CHRNB2CHRNA4CHRNB4CHRNA3TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1735267-B1 | AMINOALKYL SUBSTITUTED ESTERS AND AMIDES OF FUMARIC ACID FOR NEUTRALISING MALODOR | GIVAUDAN SA (CH) | 2008-07-23 | — | — | EP | disclosed |
| US-20070009475-A1 | Aminoalkyl substituted esters and amides of fumaric acid for neutralizing malodor | GIVAUDAN SA (CH) | 2007-01-11 | — | — | US | disclosed |
| EP-1735267-A1 | AMINOALKYL SUBSTITUTED ESTERS AND AMIDES OF FUMARIC ACID FOR NEUTRALISING MALODOR | Givaudan SA (CH) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005021051-A1 | AMINOALKYL SUBSTITUTED ESTERS AND AMIDES OF FUMARIC ACID FOR NEUTRALISING MALODOR | GIVAUDAN SA (CH) | 2005-03-10 | — | — | WO | disclosed |