Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.54 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7838701 | 0.92 | HRH3 (0.62) | HRH3MCHR1DRD2DRD4ACHE | |
| Hydrochloric Acid SCHEMBL7838165 | 0.91 | MAOA (0.53) | HRH3 | |
| Hydrochloric Acid SCHEMBL7847596 | 0.90 | MAOA (0.44) | HRH3MCHR1ACHEACACB | |
| Hydrochloric Acid SCHEMBL7849451 | 0.87 | HRH3 (0.56) | HRH3ACACB | |
| SCHEMBL7850671 | 0.86 | HRH3 (0.54) | HRH3MCHR1DRD2DRD4ACHE | |
| SCHEMBL7838474 | 0.85 | HRH3 (0.59) | HRH3MCHR1DRD2DRD4ACHE | |
| Hydrochloric Acid SCHEMBL7848542 | 0.85 | HRH3 (0.53) | HRH3MCHR1DRD2DRD4ACHE | |
| SCHEMBL7847862 | 0.84 | HRH3 (0.52) | HRH3MCHR1DRD2DRD4ACHE | |
| SCHEMBL7850491 | 0.84 | HRH3 (0.47) | HRH3MCHR1ACHE | |
| Hydrochloric Acid SCHEMBL7848563 | 0.84 | CLPP (0.43) | HRH3MCHR1DRD2DRD4ACHE |
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 |