Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5505497 | 1.00 | ACHE (0.45) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL5505503 | 0.75 | ACHE (0.46) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL5504700 | 0.75 | ACHE (0.46) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL5500616 | 0.73 | HRH3 (0.44) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL4382015 | 0.71 | DRD2 (0.40) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL4382006 | 0.71 | DRD2 (0.40) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL4387862 | 0.71 | DRD2 (0.40) | ACHEDRD2DRD4DRD3HRH3 | |
| SCHEMBL5500642 | 0.68 | DRD2 (0.43) | ACHEDRD2DRD4DRD3RECQL | |
| SCHEMBL14543588 | 0.66 | ACHE (0.86) | ACHEDRD2DRD4DRD3HRH3 | |
| Hydrochloric Acid SCHEMBL4324912 | 0.66 | DRD2 (0.63) | ACHEDRD2DRD4DRD3RECQL |
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-1847530-A1 | DIAMINE DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2007-10-24 | — | — | EP | disclosed |