Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 3/20 | 0.41 |
| ▸ | AKT2 | P31751 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL5338540 | 0.92 | AKT1 (0.46) | AKT1AKT2ALDH1A1GAALMNA | |
| SCHEMBL5344560 | 0.91 | MAPK14 (0.42) | AKT1AKT2PTGS1PTGS2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5344599 | 0.91 | AKT1 (0.45) | AKT1AKT2ALDH1A1GAALMNA | |
| SCHEMBL5342012 | 0.88 | AKT1 (0.44) | AKT1AKT2PTGS1PTGS2ALDH1A1 | |
| SCHEMBL5346776 | 0.87 | AKT1 (0.42) | AKT1AKT2GAALMNACCNA2 | |
| SCHEMBL5343644 | 0.87 | GRIN1 (0.46) | AKT1AKT2PTGS1PTGS2ALDH1A1 | |
| SCHEMBL5343214 | 0.83 | TDP1 (0.47) | AKT1AKT2ALDH1A1GAAATM | |
| SCHEMBL5324596 | 0.81 | TDP1 (0.46) | AKT1AKT2ALDH1A1GAAATM | |
| SCHEMBL5340690 | 0.81 | MAOB (0.40) | ALDH1A1GAAATMLMNACCNA2 | |
| SCHEMBL5344366 | 0.81 | TDP1 (0.43) | AKT1AKT2ALDH1A1GAAATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007096764-A2 | BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS | GLENMARK PHARMACEUTICALS S.A. (US) | 2007-08-30 | — | — | WO | claimed |
| WO-2007096764-A2 | BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS | GLENMARK PHARMACEUTICALS S.A. (US) | 2007-08-30 | — | — | WO | disclosed |