Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.70 |
| ▸ | TNF | P01375 | 4/20 | 0.70 |
| ▸ | PDE4A | P27815 | 2/20 | 0.70 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.70 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.70 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.70 |
| ▸ | USP2 | O75604 | 1/20 | 0.70 |
| ▸ | LMNA | P02545 | 1/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.70 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.70 |
| ▸ | ACHE | P22303 | 1/20 | 0.70 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.70 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.70 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.57 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.57 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL6780041 | 0.85 | ADORA2B (0.65) | ADORA2BTNFPDE4APDE4BPDE4C | |
| Bisdionin C SCHEMBL10018600 | 0.84 | CHIT1 (0.75) | ADORA2BTNFPDE4APDE4BPDE4C | |
| Bisdionin D SCHEMBL16120988 | 0.84 | ADORA2B (0.79) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL6785799 | 0.84 | ADORA2B (0.64) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL10519753 | 0.83 | ADORA2B (0.92) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL6780377 | 0.82 | ADORA2B (0.62) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL10521463 | 0.82 | ADORA2B (0.64) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL7273282 | 0.82 | ADORA2B (0.62) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL6778554 | 0.82 | ADORA2B (0.62) | ADORA2BTNFPDE4APDE4BPDE4C | |
| SCHEMBL16120981 | 0.82 | ADORA2B (0.77) | ADORA2BTNFPDE4APDE4BPDE4C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55053292-A | — | — | None | — | — | JP | disclosed |
| JP-56068681-A | — | — | None | — | — | JP | disclosed |
| JP-S5668681-A | PREPARATION OF XANTHINE DERIVATIVE | NISSEI KAGAKU KOGYOSHO:KK | 1981-06-09 | — | — | JP | disclosed |
| JP-S5553292-A | XANTHINE DERIVATIVE | GRELAN PHARMACEUT CO LTD | 1980-04-18 | — | — | JP | disclosed |