Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PREP | P48147 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL13944478 | 1.00 | CHRM2 (0.42) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL4050279 | 1.00 | CHRM2 (0.42) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL4191884 | 1.00 | CHRM2 (0.42) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL30723481 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL30723452 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL30723502 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL22949990 | 0.84 | CHRM2 (0.38) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL8350117 | 0.83 | CHRM2 (0.40) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL23273865 | 0.80 | CHRM2 (0.41) | CHRM2CHRM1CHRM3ARHSD17B10 | |
| SCHEMBL22587052 | 0.80 | CHRM2 (0.41) | CHRM2CHRM1CHRM3ARHSD17B10 |
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-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | disclosed |
| EP-1546150-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | Amura Therapeutics Limited (GB) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004007501-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | AMURA THERAPEUTICS LIMITED (GB) | 2004-01-22 | — | — | WO | disclosed |