Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.52 |
| ▸ | ACACB | O00763 | 5/20 | 0.51 |
| ▸ | MOGAT2 | Q3SYC2 | 4/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7846452 | 0.99 | HRH3 (0.52) | HRH3ACACBMOGAT2ITGB3ITGA2B | |
| SCHEMBL7846492 | 0.96 | HRH3 (0.48) | HRH3ACACBMOGAT2ITGB3ITGA2B | |
| SCHEMBL7847045 | 0.91 | HRH3 (0.49) | HRH3ACACBMOGAT2ITGB3ITGA2B | |
| SCHEMBL7838474 | 0.86 | HRH3 (0.59) | HRH3ACACBITGB3ITGA2BHRH1 | |
| SCHEMBL7846276 | 0.81 | HRH3 (0.47) | HRH3ACACBMOGAT2ITGB3ITGA2B | |
| SCHEMBL7837933 | 0.81 | HRH3 (0.48) | HRH3ACACBITGB3ITGA2BHRH1 | |
| SCHEMBL7848460 | 0.80 | HRH3 (0.48) | HRH3ACACBITGB3ITGA2BHRH1 | |
| Hydrochloric Acid SCHEMBL7847888 | 0.80 | ACACB (0.53) | HRH3ACACBMOGAT2MCHR1 | |
| Hydrochloric Acid SCHEMBL7853091 | 0.79 | HRH3 (0.47) | HRH3ACACBMCHR1 | |
| Hydrochloric Acid SCHEMBL7848692 | 0.79 | HRH3 (0.60) | HRH3ACACBCYP2D6 |
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-1122252-A1 | NITROGENOUS FUSED HETEROCYCLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME | Takeda Chemical Industries, Ltd. (JP) | 2001-08-08 | — | — | EP | disclosed |