Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADCY10 | Q96PN6 | 6/20 | 0.36 |
| ▸ | NMT1 | P30419 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18603240 | 0.84 | ADCY10 (0.35) | ADCY10NMT1CHRM4HTT | |
| SCHEMBL21171808 | 0.81 | NMT1 (0.35) | ADCY10NMT1CHRM4HTT | |
| SCHEMBL18646449 | 0.77 | ADCY10 (0.32) | ADCY10NMT1 | |
| SCHEMBL18622401 | 0.73 | ALDH1A1 (0.34) | NMT1CHRM4HTT | |
| SCHEMBL13106183 | 0.73 | HSD11B1 (0.37) | ADCY10NMT1CHRM4PROKR1 | |
| SCHEMBL13106181 | 0.68 | CHRM4 (0.35) | NMT1CHRM4HTT | |
| SCHEMBL18622406 | 0.66 | NMT1 (0.42) | NMT1CHRM4PROKR1 | |
| SCHEMBL13106187 | 0.64 | CHRM4 (0.41) | NMT1CHRM4PROKR1 | |
| SCHEMBL13106276 | 0.64 | CHRM4 (0.43) | NMT1CHRM4PROKR1 | |
| SCHEMBL20843888 | 0.63 | — | — |
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-3347353-B1 | PYRAZOLYL-SUBSTITUTED HETEROARYLS AND THEIR USE AS MEDICAMENTS | BOEHRINGER INGELHEIM INT (DE) | 2019-07-17 | — | — | EP | disclosed |