Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.60 |
| ▸ | DRD1 | P21728 | 3/20 | 0.60 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.59 |
| ▸ | DRD4 | P21917 | 3/20 | 0.54 |
| ▸ | DRD3 | P35462 | 3/20 | 0.54 |
| ▸ | DRD5 | P21918 | 2/20 | 0.54 |
| ▸ | PNMT | P11086 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL23258818 | 0.91 | PNMT (0.57) | DRD2DRD1SIGMAR1DRD4PNMT | |
| SCHEMBL3054852 | 0.91 | CA9 (0.62) | DRD2DRD1SIGMAR1DRD4DRD3 | |
| SCHEMBL11476179 | 0.84 | DRD2 (0.57) | DRD2DRD1SIGMAR1DRD4DRD3 | |
| SCHEMBL10675304 | 0.83 | ABCB1 (0.62) | SIGMAR1DRD4DRD3CA9 | |
| SCHEMBL1960380 | 0.82 | SIGMAR1 (0.71) | SIGMAR1DRD4ACHE | |
| Hydrochloric Acid SCHEMBL8791549 | 0.81 | SIGMAR1 (0.68) | SIGMAR1ACHE | |
| SCHEMBL3692387 | 0.80 | ESR1 (0.58) | DRD2SIGMAR1DRD4DRD3CA9 | |
| SCHEMBL1587871 | 0.80 | SIGMAR1 (0.58) | DRD2SIGMAR1DRD3 | |
| SCHEMBL7847794 | 0.79 | DRD2 (0.58) | DRD2DRD1SIGMAR1DRD4DRD3 | |
| SCHEMBL4650794 | 0.79 | SIGMAR1 (0.74) | DRD2SIGMAR1DRD4DRD3ACHE |
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 |