Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | AKT2 | P31751 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL5343214 | 0.95 | TDP1 (0.47) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5324596 | 0.93 | TDP1 (0.46) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5344366 | 0.90 | TDP1 (0.43) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5354199 | 0.87 | NR1H4 (0.44) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5344560 | 0.87 | MAPK14 (0.42) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5338540 | 0.85 | AKT1 (0.46) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5342580 | 0.85 | TDP1 (0.47) | TDP1NR3C1PGRMAOBADORA2A | |
| Hydrochloric Acid SCHEMBL5344599 | 0.84 | AKT1 (0.45) | TDP1NR3C1PGRAKT1AKT2 | |
| SCHEMBL5346776 | 0.81 | AKT1 (0.42) | TDP1AKT1AKT2MAOBADORA2A | |
| SCHEMBL5350061 | 0.80 | TDP1 (0.39) | TDP1NR3C1PGRAKT1AKT2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007096764-A2 | BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS | GLENMARK PHARMACEUTICALS S.A. (US) | 2007-08-30 | — | — | WO | disclosed |