Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 12/20 | 0.47 |
| ▸ | DRD4 | P21917 | 12/20 | 0.47 |
| ▸ | DRD3 | P35462 | 12/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL102930 | 1.00 | DRD2 (0.47) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL103640 | 0.91 | MEN1 (0.47) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL103639 | 0.91 | MEN1 (0.47) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL103483 | 0.88 | MEN1 (0.42) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL104068 | 0.84 | DRD2 (0.50) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL102543 | 0.79 | MEN1 (0.47) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL102207 | 0.79 | MEN1 (0.47) | DRD2DRD4DRD3MEN1GAA | |
| SCHEMBL3596349 | 0.77 | ALDH1A1 (0.49) | MEN1GAAKMT2ANPC1KDM4E | |
| SCHEMBL3596344 | 0.77 | ALDH1A1 (0.49) | MEN1GAAKMT2ANPC1KDM4E | |
| SCHEMBL104179 | 0.77 | NPC1 (0.43) | DRD2MEN1KMT2ANPC1HTR7 |
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-2426113-B1 | CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER | KOWA CO (JP) | 2013-11-06 | — | — | EP | disclosed |
| EP-2426113-A1 | CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER | Kowa Company, Ltd. (JP) | 2012-03-07 | — | — | EP | disclosed |