Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 20/20 | 0.87 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.70 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.70 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.69 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL18895597 | 1.00 | GRM2 (0.87) | GRM2KCNH2NR1I2CACNA1CGRM3 | |
| SCHEMBL14933045 | 0.93 | GRM2 (1.00) | GRM2KCNH2NR1I2CACNA1CGRM3 | |
| SCHEMBL14933054 | 0.93 | GRM2 (1.00) | GRM2KCNH2NR1I2CACNA1CGRM3 | |
| SCHEMBL18895662 | 0.90 | GRM2 (0.88) | GRM2KCNH2NR1I2CACNA1CGRM3 | |
| SCHEMBL16168968 | 0.89 | GRM2 (0.73) | GRM2KCNH2NR1I2 | |
| SCHEMBL16168970 | 0.88 | GRM2 (0.88) | GRM2KCNH2CACNA1CGRM3 | |
| SCHEMBL18895633 | 0.88 | GRM2 (0.89) | GRM2KCNH2NR1I2CACNA1CGRM3 | |
| SCHEMBL18895607 | 0.88 | GRM2 (0.88) | GRM2KCNH2CACNA1CGRM3 | |
| SCHEMBL18895670 | 0.88 | GRM2 (0.88) | GRM2KCNH2NR1I2CACNA1CGRM3 | |
| SCHEMBL18895668 | 0.87 | GRM2 (0.90) | GRM2KCNH2NR1I2CACNA1CGRM3 |
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 |
|---|---|---|---|---|---|---|---|
| US-9663506-B2 | Quinoline carboxamide and quinoline carbonitrile derivatives as mGluR2-negative allosteric modulators, compositions, and their use | MERCK SHARP & DOHME CORP. (US) | 2017-05-30 | — | — | US | disclosed |