Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPID | Q08752 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PRNP | P04156 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6832085 | 0.75 | CYP3A4 (0.46) | TSHRCYP1A2CYP3A4CYP2D6PRMT1 | |
| SCHEMBL9712251 | 0.74 | MMP8 (0.52) | PPIDNPC1RAB9ASMN1; SMN2MMP8 | |
| SCHEMBL4074798 | 0.72 | PPID (0.46) | PPIDHSD11B1SMN1; SMN2ALOX5 | |
| SCHEMBL11771628 | 0.71 | MMP8 (0.50) | PPIDNPC1RAB9ASMN1; SMN2MMP8 | |
| SCHEMBL3256326 | 0.71 | NPC1 (0.62) | PPIDNPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL7764897 | 0.71 | PPID (0.42) | PPIDHSD11B1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7764894 | 0.71 | PPID (0.42) | PPIDHSD11B1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9037437 | 0.71 | MMP8 (0.52) | PPIDHSD11B1SMN1; SMN2MMP8CYP3A4 | |
| SCHEMBL5972695 | 0.71 | SMN1; SMN2 (0.47) | PPIDHSD11B1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL5750562 | 0.70 | MMP8 (0.51) | PPIDSMN1; SMN2MMP8ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-6805893-B2 | 3-MERCAPTO-2-METHYL-BUTAN-1-OL STEREOISOMERS OR ENANTIOMORPHS ARE USED TO FLAVOR FOODS AND/OR BEVERAGES | GIVAUDAN SA (CH) | 2004-10-19 | — | — | US | disclosed |
| US-20040047960-A1 | Mercapto-alkanol flavor compounds | GIVAUDAN SA | 2004-03-11 | — | — | US | disclosed |
| US-6610346-B1 | 3- mercapto-2-methyl-butan-1-ol and/or 3-mercapto-3-methyl-hexan-1- ol, and the stereoisomers of each, are used to flavor products, such as foods and/or beverages. Methods for the preparation of both | GIVAUDAN SCHWEIZ AG (CH) | 2003-08-26 | — | — | US | disclosed |
| EP-1055667-A2 | Mercapto alcohols as flavouring compounds | Givaudan SA (CH) | 2000-11-29 | — | — | EP | disclosed |