Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | CHKA | P35790 | 2/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10464560 | 0.93 | PYCR1 (0.43) | HDAC1PYCR1ALDH1A1HTTRAB9A | |
| SCHEMBL5544288 | 0.82 | AOC3 (0.49) | CHKAAOC3CNR2CNR1 | |
| SCHEMBL8263076 | 0.81 | NR1H2 (0.54) | HDAC1ALDH1A1NR1H2NR1H3PTGDR2 | |
| SCHEMBL5545430 | 0.81 | CRHBP (0.53) | HDAC1ALDH1A1NR1H2NR1H3CRHBP | |
| SCHEMBL12844706 | 0.78 | HDAC1 (0.48) | HDAC1PYCR1ALDH1A1HTTRAB9A | |
| SCHEMBL9807149 | 0.77 | CRHBP (0.57) | HDAC1PYCR1ALDH1A1HTTRAB9A | |
| SCHEMBL863542 | 0.77 | TSHR (0.50) | PYCR1ALDH1A1RAB9ANR1H2NR1H3 | |
| SCHEMBL15087673 | 0.76 | CNR2 (0.57) | CNR2CNR1 | |
| SCHEMBL29336627 | 0.75 | BCL2A1 (0.56) | HDAC1PYCR1ALDH1A1HTTCNR2 | |
| SCHEMBL9657994 | 0.73 | SLC2A1 (0.45) | HDAC1PYCR1ALDH1A1HTTRAB9A |
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-0407955-A1 | New hetrazepines acting as PAF antagonists, process for their production and their use as drugs | BOEHRINGER INGELHEIM KG (DE) | 1991-01-16 | — | — | EP | disclosed |