Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.38 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.38 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 5/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 2/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7138373 | 0.92 | ABCB1 (0.47) | ABCB1ABCC1MMP8MMP1MMP2 | |
| SCHEMBL7138025 | 0.88 | KCNQ4 (0.38) | ABCB1ABCC1KCNQ4KCNQ5MMP8 | |
| SCHEMBL7143138 | 0.88 | MEN1 (0.37) | ABCB1ABCC1KCNQ4KCNQ5MMP8 | |
| SCHEMBL7139923 | 0.87 | ALDH1A1 (0.40) | ABCB1ABCC1KCNQ4KCNQ5ALDH1A1 | |
| SCHEMBL7143992 | 0.87 | MAPT (0.40) | ABCB1ABCC1KCNQ4KCNQ5MMP8 | |
| SCHEMBL7145942 | 0.86 | KCNQ4 (0.36) | ABCB1ABCC1KCNQ4KCNQ5MMP8 | |
| SCHEMBL7146551 | 0.86 | ABCB1 (0.39) | ABCB1ABCC1KCNQ4KCNQ5MMP8 | |
| SCHEMBL7142774 | 0.85 | KCNQ4 (0.38) | ABCB1ABCC1KCNQ4KCNQ5MMP8 | |
| SCHEMBL7138538 | 0.84 | RAB9A (0.41) | MMP8MMP1MMP2MMP9MMP13 | |
| SCHEMBL7145392 | 0.82 | HDAC2 (0.44) | KCNQ4KCNQ5CYP17A1GRM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1224174-B1 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2003-09-17 | — | — | EP | disclosed |
| EP-1224174-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| US-6407094-B1 | 4-5-DIDEHYDRO-1,5-BENZODIAZEPIN-2-ONE DERIVATIVES; PSYCHOLOGICAL, NERVOUS SYSTEM, AND BRAIN DISORDERS; COGNITION ACTIVATORS; ALZHEIMER*S DISEASE, SCHIZOPHRENIA | HOFFMANN-LA ROCHE INC. | 2002-06-18 | — | — | US | disclosed |
| WO-2001029011-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |