Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 4/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.38 |
| ▸ | PDE2A | O00408 | 2/20 | 0.37 |
| ▸ | PDE1A | P54750 | 2/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.37 |
| ▸ | PNP | P00491 | 2/20 | 0.37 |
| ▸ | CFTR | P13569 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5664376 | 0.86 | PDE4A (0.39) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL7442906 | 0.85 | ADORA2A (0.41) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL7173171 | 0.84 | ADORA2A (0.40) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL8362525 | 0.81 | PNP (0.36) | PDE4APDE4BPDE4CPDE4DADORA2B | |
| SCHEMBL601906 | 0.81 | PNP (0.34) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL27842808 | 0.80 | PDE4A (0.53) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL28071828 | 0.80 | PNP (0.45) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL8362387 | 0.80 | PNP (0.36) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL5504400 | 0.79 | ADORA2A (0.59) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL7617801 | 0.79 | ADORA2A (0.40) | PDE4APDE4BPDE4CPDE4DADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5958980-A | TREATMENT OF CANCER BY ADMINISTERING TO THE MAMMAL IN NEED OF TREATMENT 4-(2-FORMYL-3-HYDROXYPHENOXYMETHYL)BENZOIC ACID OR A SALT, WHEREIN THE EFFECTIVE AMOUNT IS 50 TO 200 MG PER DAY WITHOUT SUBJECTING SAID MAMMAL TO RADIOTHERAPY DURING THE | GLAXO WELLCOME, INC. (US) | 1999-09-28 | — | — | US | disclosed |
| US-5872151-A | ADMINISTERING TO AN IMMUNODEFICIENT PATIENT FOR TREATMENT OF VIRUS INFECTIONS AN IMMUNOPOTENTIATORY AMOUNT OF 4-(2-FORMYL-3-HYDROXYPHENOXYMETHYL)BENZOIC ACID OR SALTS | GLAXO WELLCOME INC. (US) | 1999-02-16 | — | — | US | disclosed |