Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16106143 | 0.83 | MEN1 (0.73) | CA1CA2KMT2AMEN1ALDH1A1 | |
| SCHEMBL25681987 | 0.82 | KMT2A (0.72) | CA1CA2LMNAKMT2AMEN1 | |
| SCHEMBL28229345 | 0.82 | ALDH1A1 (0.56) | CA1CA2KMT2AMEN1ALDH1A1 | |
| SCHEMBL12125172 | 0.80 | HSD17B10 (0.57) | HTTLMNAKMT2AMEN1ALDH1A1 | |
| SCHEMBL26741111 | 0.79 | HSD17B10 (0.56) | HTTNPSR1KMT2AMEN1ALDH1A1 | |
| SCHEMBL26741143 | 0.79 | HSD17B10 (0.56) | HTTNPSR1KMT2AMEN1ALDH1A1 | |
| SCHEMBL9979425 | 0.79 | HPGD (0.59) | KMT2AMEN1ALDH1A1MAPK1HSD17B10 | |
| SCHEMBL3132889 | 0.78 | CA1 (0.63) | CA1CA2LMNAKMT2AMEN1 | |
| SCHEMBL25000794 | 0.76 | KMT2A (0.64) | CA1CA2LMNAKMT2AMEN1 | |
| SCHEMBL15604014 | 0.76 | ALDH1A1 (0.64) | CA1CA2LMNAKMT2AMEN1 |
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-20060052276-A1 | Armoise Tunisian oil, para-t-butylphenylacetonitrile, dihydrolinalol, N-ethyl-N-(3-methylphenyl)propionamide, 4-(5-ethylbicyclo[2.2.1]heptyl-2)-cyclohexanol, ethyltricyclo[5.2.1.0{2,6}]decane-2-carboxylate; inhibiting the biotransformation of androstadienols to androstenones | QUEST INTERNATIONAL SERVICES B.V. (NL) | 2006-03-09 | — | — | US | claimed |
| WO-2024003176-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2024-01-04 | — | — | WO | disclosed |
| EP-2652102-B1 | MOC COMPOSITIONS | GIVAUDAN SA (CH) | 2016-09-14 | — | — | EP | disclosed |
| WO-2011110614-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-09-15 | — | — | WO | disclosed |