Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 4/20 | 0.64 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.60 |
| ▸ | PDE4A | P27815 | 2/20 | 0.60 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.60 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.60 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.60 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.55 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.53 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7459098 | 0.99 | TNF (0.62) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7460040 | 0.96 | TNF (0.63) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7463585 | 0.89 | PDE4A (0.57) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7457242 | 0.87 | PDE4A (0.53) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7457088 | 0.87 | PDE4A (0.64) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL8657381 | 0.87 | TNF (0.60) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7455860 | 0.86 | PDE4A (0.63) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL8658556 | 0.86 | TNF (0.59) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7557802 | 0.85 | ADORA2B (0.57) | TNFADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL7455411 | 0.85 | PDE4A (0.51) | TNFADORA2BPDE4APDE4BPDE4C |
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 |
|---|---|---|---|---|---|---|---|
| EP-0771813-B1 | Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines | HOECHST AG (DE) | 2002-01-16 | — | — | EP | disclosed |
| EP-0771813-A1 | Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-07 | — | — | EP | disclosed |