Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | HPGD | P15428 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 5/20 | 0.36 |
| ▸ | AKT2 | P31751 | 5/20 | 0.36 |
| ▸ | AKT3 | Q9Y243 | 5/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6953953 | 0.90 | GRM2 (0.41) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6951472 | 0.87 | ALDH1A1 (0.47) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6951754 | 0.84 | GRM2 (0.41) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6953027 | 0.83 | GRM2 (0.40) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6951385 | 0.82 | GRM2 (0.40) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6949302 | 0.81 | GRM2 (0.43) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6947212 | 0.80 | HPGD (0.41) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6951651 | 0.80 | HPGD (0.43) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6950824 | 0.80 | GRM2 (0.41) | GRM2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL6949798 | 0.80 | GRM2 (0.41) | GRM2ALDH1A1HPGDKDM4EHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1074549-B1 | Tetrahydro-benzo(d)azepines and their use as antagonists at metabotropic glutamate receptors | HOFFMANN LA ROCHE (CH) | 2003-11-19 | — | — | EP | disclosed |
| US-6218385-B1 | FOR THERAPY OR PROPHYLAXIS OF ACUTE AND/OR CHRONIC NEUROLOGICAL DISORDERS SUCH AS EPILEPSY, STROKE, CHRONIC AND ACUTE PAIN, PSYCHOSIS, SCHIZOPHRENIA, ALZHEIMER'S DISEASE, COGNITIVE DISORDERS AND MEMORY DEFICITS | HOFFMANN-LA ROCHE INC. | 2001-04-17 | — | — | US | disclosed |
| EP-1074549-A2 | Tetrahydro-benzo(d)azepines and their use as antagonists at metabotropic glutamate receptors | F. HOFFMANN-LA ROCHE AG (CH) | 2001-02-07 | — | — | EP | disclosed |