Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 19/20 | 0.88 |
| ▸ | PDE4B | Q07343 | 13/20 | 0.88 |
| ▸ | PDE4C | Q08493 | 13/20 | 0.88 |
| ▸ | PDE4D | Q08499 | 13/20 | 0.88 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | VEGFA | P15692 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | PDE5A | O76074 | 1/20 | 0.53 |
| ▸ | TNF | P01375 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | PDE1A | P54750 | 1/20 | 0.53 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5364528 | 0.94 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5322466 | 0.85 | PDE4A (0.87) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5326525 | 0.83 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5325753 | 0.82 | PDE4A (0.79) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5326457 | 0.79 | PDE4A (0.90) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5350832 | 0.79 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5322341 | 0.79 | PDE4A (0.74) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL5331581 | 0.78 | PDE4A (0.79) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL4466098 | 0.78 | PDE4A (0.74) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL27702547 | 0.78 | PDE4A (0.74) | PDE4APDE4BPDE4CPDE4DCYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4193926-A | 4-(Polyalkoxy phenyl)-2-pyrrolidones | SCHERING AKTIENGESELLSCHAFT (DE) | 1980-03-18 | — | — | US | claimed |
| US-4012495-A | USED IN TREATING NEUROLOGICAL AND PSYCHIC DISORDERS | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-03-15 | — | — | US | claimed |
| WO-2007123699-A1 | METHODS AND COMPOSITIONS FOR MODULATING MELANOGENESIS BY USING A MCLR AGONIST | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2007-11-01 | — | — | WO | disclosed |
| US-4193926-A | 4-(Polyalkoxy phenyl)-2-pyrrolidones | SCHERING AKTIENGESELLSCHAFT (DE) | 1980-03-18 | — | — | US | disclosed |
| US-4012495-A | USED IN TREATING NEUROLOGICAL AND PSYCHIC DISORDERS | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-03-15 | — | — | US | disclosed |