Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 4/20 | 0.49 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16797340 | 0.87 | GRM5 (0.42) | GRM5UCHL1GSK3BCYP2D6MEN1 | |
| SCHEMBL18151343 | 0.87 | GRM5 (0.42) | GRM5UCHL1HTTGSK3BCYP2D6 | |
| SCHEMBL27852673 | 0.86 | GRM5 (0.44) | GRM5UCHL1HTTGSK3BCYP2D6 | |
| SCHEMBL30485537 | 0.86 | GRM5 (0.44) | GRM5UCHL1HTTGSK3BCYP2D6 | |
| SCHEMBL18151571 | 0.86 | GRM5 (0.41) | GRM5UCHL1GSK3BCYP2D6MEN1 | |
| SCHEMBL30893416 | 0.85 | GRM5 (0.44) | GRM5UCHL1HTTGSK3BCYP2D6 | |
| SCHEMBL18151348 | 0.85 | GRM5 (0.43) | GRM5UCHL1HTTGSK3BCYP2D6 | |
| SCHEMBL16797343 | 0.85 | LRRK2 (0.44) | GRM5UCHL1GSK3BCYP2D6MEN1 | |
| SCHEMBL30401803 | 0.85 | GRM5 (0.40) | GRM5UCHL1HTTGSK3BCYP2D6 | |
| SCHEMBL18151573 | 0.84 | GRM5 (0.42) | GRM5UCHL1HTTGSK3BCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015134536-A1 | COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2015-09-11 | — | — | WO | disclosed |