Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 8/20 | 0.47 |
| ▸ | PDE4A | P27815 | 8/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 3/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19527766 | 0.84 | HTR1A (0.62) | HTR1AADRA2AADRA2BADRA2CSLC6A2 | |
| SCHEMBL20063995 | 0.82 | PDE4D (0.51) | PDE4BPDE4APDE4DPDE4CKCNH2 | |
| SCHEMBL5344402 | 0.81 | MCHR1 (0.49) | PDE4BPDE4APDE4DPDE4CHTR1A | |
| SCHEMBL19527662 | 0.79 | PDE4D (0.43) | PDE4BPDE4APDE4DPDE4CDRD1 | |
| SCHEMBL2242864 | 0.79 | MCHR1 (0.51) | PDE4BPDE4APDE4DPDE4CHTR1A | |
| SCHEMBL19527552 | 0.79 | HRH3 (0.48) | HTR1AADRA2AADRA2BADRA2CKMT2A | |
| SCHEMBL4654255 | 0.78 | DRD1 (0.48) | PDE4BPDE4APDE4DPDE4CDRD1 | |
| SCHEMBL19527742 | 0.78 | DRD1 (0.38) | PDE4BPDE4APDE4DPDE4CDRD1 | |
| SCHEMBL131273 | 0.78 | PDE4A (0.50) | PDE4BPDE4APDE4DPDE4C | |
| SCHEMBL20064317 | 0.78 | PDE4D (0.53) | PDE4BPDE4APDE4DPDE4CKCNH2 |
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-2018069863-A1 | 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-04-19 | — | — | WO | disclosed |