Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.42 |
| ▸ | PDE2A | O00408 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL25703814 | 0.81 | ALDH1A1 (0.43) | GRIA4PDE2ARORCMAPTCYP2C9 | |
| SCHEMBL14369491 | 0.80 | PDE2A (0.48) | ADRA2AADRA2BADRA2CHDAC8HDAC6 | |
| SCHEMBL16263690 | 0.78 | NPC1 (0.44) | ADRA2AADRA2BADRA2CHDAC8HDAC6 | |
| SCHEMBL14354503 | 0.77 | HDAC8 (0.43) | ADRA2AADRA2BADRA2CHDAC8HDAC6 | |
| SCHEMBL8648911 | 0.76 | PDE2A (0.37) | ADRA2AADRA2CPDE2AESR1AKT1 | |
| SCHEMBL1706121 | 0.75 | PDE2A (0.62) | PDE2AESR1ESR2AKT1AKT2 | |
| SCHEMBL13966644 | 0.75 | HDAC8 (0.42) | ADRA2AADRA2BADRA2CHDAC8HDAC6 | |
| SCHEMBL5877385 | 0.75 | GRIA4 (0.51) | ADRA2AADRA2BADRA2CHDAC8HDAC6 | |
| SCHEMBL13925378 | 0.75 | HIF1A (0.47) | PDE2AAKT1AKT2CYP2D6CYP2C9 | |
| SCHEMBL21465954 | 0.74 | HDAC8 (0.44) | ADRA2AADRA2BADRA2CHDAC8HDAC6 |
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-2008033455-A2 | BIPHENYL AND HETEROARYL PHENYL DERIVATIVES AS PROTEIN TYROSINE PHOSPHATASES INHIBITORS | THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) | 2008-03-20 | — | — | WO | disclosed |