Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 13/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 2/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | PDE6D | O43924 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | PDE6A | P16499 | 1/20 | 0.36 |
| ▸ | PDE6G | P18545 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE6B | P35913 | 1/20 | 0.36 |
| ▸ | PDE6C | P51160 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | PDE6H | Q13956 | 1/20 | 0.36 |
| ▸ | PDE11A | Q9HCR9 | 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 | |
|---|---|---|---|---|
| SCHEMBL681710 | 0.90 | AKT1 (0.45) | ADRB2ADRB1ADRB3AKT1RPS6KB1 | |
| SCHEMBL680749 | 0.87 | PDE2A (0.41) | ADRB2ADRB1ADRB3PDE2AFFAR1 | |
| SCHEMBL683420 | 0.86 | AKR1C3 (0.42) | ADRB2ADRB1ADRB3PDE2AFFAR1 | |
| SCHEMBL680064 | 0.85 | PDPK1 (0.44) | ADRB2ADRB1ADRB3 | |
| SCHEMBL2738399 | 0.85 | AKT1 (0.43) | ADRB2ADRB1ADRB3PDE2AFFAR1 | |
| SCHEMBL681158 | 0.84 | AKT1 (0.46) | AKT1RPS6KB1AKR1C3AKR1C2 | |
| SCHEMBL17803796 | 0.83 | ADRB2 (0.41) | ADRB2ADRB1ADRB3AKR1C3AKR1C2 | |
| SCHEMBL680149 | 0.82 | AKT1 (0.49) | PDE2AAKT1 | |
| SCHEMBL681191 | 0.82 | AKT1 (0.44) | ADRB2ADRB1ADRB3FFAR1AKT1 | |
| SCHEMBL680197 | 0.82 | ADRB2 (0.40) | ADRB2ADRB1ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-8063050-B2 | Hydroxylated and methoxylated pyrimidyl cyclopentanes as AKT protein kinase inhibitors | ARRAY BIOPHARMA INC. (US) | 2011-11-22 | — | — | US | disclosed |