Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SNCA | P37840 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TPMT | P51580 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27500363 | 0.88 | PDGFRB (0.38) | SNCAALOX15ALOX12PARP1GPR35 | |
| SCHEMBL27484337 | 0.86 | PARP1 (0.35) | SNCAALOX15ALOX12PARP1GPR35 | |
| SCHEMBL27499148 | 0.86 | CTSD (0.36) | PARP1HTTLMNAMAPTNPSR1 | |
| SCHEMBL27498854 | 0.84 | ALDH1A1 (0.35) | PARP1HTTCTSDCYP1A2CYP3A4 | |
| SCHEMBL27539422 | 0.84 | HCAR3 (0.38) | PARP1L3MBTL1MAPK1HTTMEN1 | |
| SCHEMBL27499151 | 0.83 | PARP1 (0.33) | ALOX15PARP1MAPK1HTTMAPT | |
| SCHEMBL27554338 | 0.82 | ALDH1A1 (0.36) | PARP1ALDH1A1 | |
| SCHEMBL27485132 | 0.81 | PARP1 (0.37) | SNCAPARP1HTTNPSR1CTSD | |
| SCHEMBL27485057 | 0.81 | MAPT (0.37) | L3MBTL1MAPK1HTTMEN1KMT2A | |
| SCHEMBL27486073 | 0.80 | BACE1 (0.41) | ALOX15L3MBTL1GPR35MAPK1HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1195522-C | Benzodiazepine derivatives usable as parental metabolic glutamate receptor antagonist | HOFFMANN LA ROCHE (CH) | 2005-04-06 | — | — | CN | disclosed |
| CN-1379765-A | Benzodiazepine derivatives usable as parental metabolic glutamate receptor antagonist | HOFFMANN LA ROCHE (CH) | 2002-11-13 | — | — | CN | disclosed |