Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | BRD2 | P25440 | 1/20 | 0.42 |
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 | 0.91 | ADORA2A (0.45) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL190990 | 0.85 | ADORA2A (0.59) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL9706609 | 0.85 | HPGD (0.49) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL9706689 | 0.84 | PDE4A (0.46) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL1462066 | 0.82 | PDE2A (0.46) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL13343375 | 0.81 | ADORA2A (0.55) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL9645595 | 0.81 | PDE4A (0.42) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL13368751 | 0.80 | ADORA2A (0.53) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL1460912 | 0.78 | PDE1A (0.58) | MEN1KMT2AALDH1A1HPGDTSHR | |
| SCHEMBL5233098 | 0.78 | ADORA1 (0.48) | ADORA2AADORA2B |
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 11 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-0799040-A4 | TRISUBSTITUTED THIOXANTHINES | EURO CELTIQUE SA (LU) | 1998-04-01 | — | — | EP | disclosed |
| EP-0799040-A1 | TRISUBSTITUTED THIOXANTHINES | Euroceltique S.A. (LU) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996018400-A1 | TRISUBSTITUTED THIOXANTHINES | EURO-CELTIQUE, S.A. (LU) | 1996-06-20 | — | — | WO | disclosed |
| 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 |