Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | BRD2 | P25440 | 1/20 | 0.41 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.41 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9645595 | 0.96 | PDE4A (0.42) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL7420292 | 0.92 | ADORA1 (0.44) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL8002306 | 0.86 | MAPT (0.39) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL4626790 | 0.86 | ADORA2A (0.58) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL9706596 | 0.85 | ADORA2A (0.41) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL5233098 | 0.85 | ADORA1 (0.48) | ADORA2AADORA2BCYP3A4CYP2C19 | |
| SCHEMBL7419694 | 0.84 | PDE4A (0.47) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL9645587 | 0.84 | ADORA1 (0.50) | ADORA2AADORA2BCYP3A4CYP2C19 | |
| SCHEMBL9645635 | 0.84 | ALDH1A1 (0.40) | ADORA2AMEN1ALDH1A1KMT2AADORA2B | |
| SCHEMBL9644450 | 0.82 | ADORA2A (0.53) | PDE4AADORA2APDE4BPDE4CPDE4D |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4710503-A | 6-thioxanthine derivatives | EUROCELTIQUE S.A. (LU) | 1987-12-01 | — | — | US | claimed |
| CN-86101050-A | The manufacture method of 6-Thioxanthine derivatives and application thereof | — | 1986-11-12 | — | — | CN | claimed |
| EP-0191313-B1 | 6-THIOXANTHINE DERIVATIVES | Euro-Celtique S.A. (LU) | 1992-10-28 | — | — | EP | disclosed |
| CN-1013676-B | 6-THIOXANTHINE DERIVATIVES | EURO CELTIQUE SA (US) | 1991-08-28 | — | — | CN | disclosed |
| US-4820709-A | 6-thioxanthine derivatives | EUROCELTIQUE, S.A. (LU) | 1989-04-11 | — | — | US | disclosed |
| US-4710503-A | 6-thioxanthine derivatives | EUROCELTIQUE S.A. (LU) | 1987-12-01 | — | — | US | disclosed |
| CN-86101050-A | The manufacture method of 6-Thioxanthine derivatives and application thereof | — | 1986-11-12 | — | — | CN | disclosed |
| EP-0191313-A1 | 6-Thioxanthine derivatives | Euro-Celtique S.A. (LU) | 1986-08-20 | — | — | EP | disclosed |