Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1A | P07327 | 4/20 | 0.66 |
| ▸ | ADH1C | P00326 | 3/20 | 0.66 |
| ▸ | ADH4 | P08319 | 1/20 | 0.66 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | GNAI3 | P08754 | 5/20 | 0.37 |
| ▸ | GNAO1 | P09471 | 5/20 | 0.37 |
| ▸ | GNAI1 | P63096 | 5/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3687398 | 0.95 | ADH1A (0.74) | ADH1AADH1CADH4SLC6A2SLC6A4 | |
| SCHEMBL3954264 | 0.89 | ADH1A (0.69) | ADH1AADH1CADH4SLC6A2SLC6A4 | |
| SCHEMBL1678869 | 0.87 | ADH1A (0.85) | ADH1AADH1CADH4 | |
| SCHEMBL9462694 | 0.83 | ADH1A (0.78) | ADH1AADH1CADH4 | |
| SCHEMBL12804470 | 0.83 | ADH1A (0.47) | ADH1AADH1CADH4SLC6A2SLC6A4 | |
| SCHEMBL9660884 | 0.81 | ADH1A (0.79) | ADH1AADH1CADH4 | |
| SCHEMBL9658881 | 0.81 | ADH1A (0.79) | ADH1AADH1CADH4 | |
| SCHEMBL726395 | 0.81 | ADH1A (0.79) | ADH1AADH1CADH4 | |
| SCHEMBL1678852 | 0.81 | ADH1A (0.96) | ADH1AADH1CADH4EPHX1 | |
| SCHEMBL3955640 | 0.81 | ADH1A (0.64) | ADH1AADH1CADH4SLC6A2SLC6A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017021728-A9 | MUSCARINIC AGONISTS | HEPTARES THERAPEUTICS LIMTED (GB) | 2017-04-27 | — | — | WO | disclosed |
| WO-2017021728-A1 | MUSCARINIC AGONISTS | HEPTARES THERAPEUTICS LIMTED (GB) | 2017-02-09 | — | — | WO | disclosed |