Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | LIPE | Q05469 | 12/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | MMP14 | P50281 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8105650 | 1.00 | ACACB (0.36) | ACACBLIPEALDH1A1HTTMCHR1 | |
| SCHEMBL8111197 | 0.89 | ACACB (0.34) | ACACBLIPEALDH1A1HTTMMP13 | |
| SCHEMBL8111199 | 0.89 | ACACB (0.34) | ACACBLIPEALDH1A1HTTMMP13 | |
| SCHEMBL6832831 | 0.86 | CYP3A4 (0.39) | ACACBLIPEHTTKMT2A | |
| SCHEMBL8105299 | 0.80 | ACACB (0.34) | ACACBALDH1A1HTTMEN1KMT2A | |
| SCHEMBL8105302 | 0.80 | ACACB (0.34) | ACACBALDH1A1HTTMEN1KMT2A | |
| SCHEMBL8540080 | 0.78 | SCN9A (0.36) | ACACBLIPEHTTKMT2ASCN9A | |
| SCHEMBL8106760 | 0.77 | CYP3A4 (0.49) | — | |
| SCHEMBL8112842 | 0.76 | CYP3A4 (0.39) | SCN9A | |
| SCHEMBL8581584 | 0.75 | ACACB (0.36) | ACACBLIPEALDH1A1HTTMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1033367-A2 | Process for the preparation of optically active triazole derivatives and their imidazolidin-2-one intermediates | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-09-06 | — | — | EP | disclosed |
| US-5677464-A | Production of optically active triazole compounds and their intermediates | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-10-14 | — | — | US | disclosed |
| EP-0687672-A2 | Production of optically active triazole compounds and their intermediates | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-12-20 | — | — | EP | disclosed |