Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.39 |
| ▸ | HTT | P42858 | 5/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | LMNA | P02545 | 5/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL6949790 | 0.84 | ALDH1A1 (0.41) | ALDH1A1HTTNPSR1MAPK1HSD17B10 | |
| SCHEMBL6955347 | 0.82 | LMNA (0.51) | ALDH1A1NPSR1MAPK1HSD17B10TSHR | |
| SCHEMBL6953029 | 0.82 | GRM2 (0.40) | ALDH1A1HTTNPSR1MAPK1HSD17B10 | |
| SCHEMBL6949293 | 0.82 | MEN1 (0.39) | ALDH1A1HTTHSD17B10HPGDMEN1 | |
| SCHEMBL6947632 | 0.81 | PIK3CD (0.39) | ALDH1A1HTTNPSR1MAPK1HSD17B10 | |
| SCHEMBL6955735 | 0.80 | ADRA2A (0.38) | ALDH1A1HTTNPSR1MAPK1HSD17B10 | |
| SCHEMBL6949864 | 0.80 | HRH4 (0.36) | ALDH1A1HTTNPSR1MAPK1HSD17B10 | |
| SCHEMBL11836332 | 0.79 | ALDH1A1 (0.48) | ALDH1A1HTTNPSR1MAPK1HSD17B10 | |
| SCHEMBL6956323 | 0.78 | MKNK1 (0.47) | MKNK1ALDH1A1HTTHSD17B10TSHR | |
| SCHEMBL11826232 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HTTNPSR1MAPK1HSD17B10 |
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 |