Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.42 |
| ▸ | PDE4A | P27815 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | PDE1A | P54750 | 1/20 | 0.41 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.41 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.38 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.38 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9706669 | 0.88 | ADORA2A (0.45) | HPGDHTTADORA2APDE4APDE4B | |
| SCHEMBL7419694 | 0.85 | PDE4A (0.47) | HPGDADORA2APDE4APDE4BPDE4C | |
| SCHEMBL10963141 | 0.83 | ADORA2A (0.55) | HPGDHTTADORA2APDE4APDE4B | |
| SCHEMBL1460912 | 0.83 | PDE1A (0.58) | HPGDHTTPDE2APDE1APDE1B | |
| SCHEMBL9706596 | 0.83 | ADORA2A (0.41) | HPGDHTTADORA2APDE4APDE4B | |
| SCHEMBL7423089 | 0.80 | ADORA2A (0.39) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9645623 | 0.78 | CYP3A4 (0.45) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7676923 | 0.78 | ADORA1 (0.56) | ADORA2ACYP1A2LMNAPMP22MEN1 | |
| SCHEMBL7863965 | 0.74 | ADORA2B (0.58) | HPGDADORA2ACYP1A2CYP3A4MAPK1 | |
| SCHEMBL28143495 | 0.73 | SIRT1 (0.67) | HPGDADORA2APDE2APDE1APDE1B |
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-4820709-A | 6-thioxanthine derivatives | EUROCELTIQUE, S.A. (LU) | 1989-04-11 | — | — | 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 |