Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | PDE4A | P27815 | 3/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.44 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.44 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | PDE1A | P54750 | 1/20 | 0.43 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.43 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7419694 | 0.91 | PDE4A (0.47) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL9706609 | 0.88 | HPGD (0.49) | ADORA2AADORA2BADORA1PDE4APDE4B | |
| SCHEMBL7420292 | 0.84 | ADORA1 (0.44) | ADORA2AADORA2BADORA1PDE4APDE4B | |
| SCHEMBL5231243 | 0.81 | PDE2A (0.46) | ADORA2AADORA2BADORA1PDE4APDE4B | |
| SCHEMBL7423540 | 0.81 | ADORA2A (0.45) | ADORA2AADORA2B | |
| SCHEMBL1460912 | 0.81 | PDE1A (0.58) | HPGDSIRT1SIRT3SIRT5BLM | |
| SCHEMBL5233098 | 0.80 | ADORA1 (0.48) | ADORA2AADORA2BADORA1 | |
| SCHEMBL7425220 | 0.79 | ADORA1 (0.69) | ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL9645587 | 0.79 | ADORA1 (0.50) | ADORA2AADORA2BADORA1 | |
| SCHEMBL7866628 | 0.79 | ADORA2B (0.61) | ADORA2AADORA2BADORA1ADORA3HSD17B10 |
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-4710503-A | 6-thioxanthine derivatives | EUROCELTIQUE S.A. (LU) | 1987-12-01 | — | — | US | claimed |
| EP-0191313-B1 | 6-THIOXANTHINE DERIVATIVES | Euro-Celtique S.A. (LU) | 1992-10-28 | — | — | EP | 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 |
| EP-0191313-A1 | 6-Thioxanthine derivatives | Euro-Celtique S.A. (LU) | 1986-08-20 | — | — | EP | disclosed |