Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 12/20 | 0.40 |
| ▸ | HTR1A | P08908 | 7/20 | 0.40 |
| ▸ | DRD1 | P21728 | 7/20 | 0.40 |
| ▸ | DRD4 | P21917 | 7/20 | 0.40 |
| ▸ | DRD5 | P21918 | 7/20 | 0.40 |
| ▸ | DRD3 | P35462 | 7/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.37 |
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 SCHEMBL4858496 | 0.99 | DRD2 (0.40) | DRD2HTR1ADRD1DRD4DRD5 | |
| Hydrochloric Acid SCHEMBL4853592 | 0.94 | DRD2 (0.42) | DRD2HTR1ADRD1DRD4DRD5 | |
| Hydrochloric Acid SCHEMBL4856840 | 0.87 | DRD2 (0.49) | DRD2DRD3SLC6A4 | |
| SCHEMBL4256446 | 0.84 | DRD2 (0.49) | DRD2HTR1ADRD1DRD4DRD5 | |
| Hydrochloric Acid SCHEMBL5014926 | 0.83 | DRD2 (0.48) | DRD2HTR1ADRD1DRD4DRD5 | |
| SCHEMBL14064783 | 0.81 | DRD2 (0.48) | DRD2HTR1ADRD1DRD4DRD5 | |
| Hydrochloric Acid SCHEMBL4849900 | 0.81 | DRD2 (0.47) | DRD2HTR1ADRD1DRD4DRD5 | |
| Hydrochloric Acid SCHEMBL4853403 | 0.81 | DRD2 (0.47) | DRD2HTR1ADRD1DRD4DRD5 | |
| SCHEMBL18092204 | 0.80 | DRD2 (0.45) | DRD2DRD1DRD4DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL4854734 | 0.80 | SIGMAR1 (0.51) | DRD2HTR1ADRD1DRD4DRD5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1698620-B1 | BENZENE COMPOUNDS DISUBSTITUTED WITH CYCLIC GROUPS AT THE 1- AND 2-POSITIONS | EISAI R&D MAN CO LTD (JP) | 2016-09-28 | — | — | EP | disclosed |
| EP-1698620-A1 | BENZENE COMPOUNDS DISUBSTITUTED WITH CYCLIC GROUPS AT THE 1- AND 2-POSITIONS | Eisai Co., Ltd. (JP) | 2006-09-06 | — | — | EP | disclosed |