Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNP | P00491 | 2/20 | 1.00 |
| ▸ | PDE4A | P27815 | 5/20 | 0.64 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.64 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.64 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.64 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.64 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.61 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.61 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | MPO | P05164 | 1/20 | 0.60 |
| ▸ | TPO | P07202 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | BRD4 | O60885 | 1/20 | 0.53 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL27859109 | 0.89 | PNP (0.79) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7681629 | 0.89 | PNP (0.80) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9031047 | 0.86 | PNP (0.75) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL28874054 | 0.84 | PNP (0.72) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL985624 | 0.80 | PNP (0.66) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3107001 | 0.79 | ADORA3 (0.78) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5515323 | 0.78 | ADORA2A (0.71) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7466316 | 0.78 | ADORA2A (1.00) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL1461128 | 0.77 | PNP (0.62) | PNPPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6360066 | 0.77 | ADORA2B (0.75) | PNPPDE4APDE4BPDE4CPDE4D |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109796453-A | A kind of preparation method of 1,7- dimethyl xanthine | 南京纽邦生物科技有限公司 | 2019-05-24 | — | — | CN | disclosed |
| EP-0417790-B1 | S-triazolo[3,4-i]purine derivatives | KYOWA HAKKO KOGYO KK (JP) | 1996-12-04 | — | — | EP | disclosed |
| EP-0528164-B1 | Use of xanthine derivatives for the manufacture of a medicament for the treatment of secondary nerve cell damages and function disorders after head-brain-traumata | HOECHST AG (DE) | 1996-05-29 | — | — | EP | disclosed |
| US-5409935-A | Inhibit formation of free radicals | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-04-25 | — | — | US | disclosed |
| EP-0369744-B1 | Xanthine derivatives, process for their preparation and pharmaceutical compositions | SMITHKLINE BEECHAM PHARMA GMBH (DE) | 1994-09-21 | — | — | EP | disclosed |
| US-5321029-A | Vascular and skin disorders; bronchodilator | BEECHAM-WUELFING GMBH & CO.K.G. (DE) | 1994-06-14 | — | — | US | disclosed |
| EP-0319854-B1 | Process for the methylation of xanthins | BOEHRINGER INGELHEIM KG (DE) | 1994-03-02 | — | — | EP | disclosed |
| US-5270316-A | Condensed purine derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1993-12-14 | — | — | US | disclosed |
| EP-0528164-A2 | Use of xanthine derivatives for the manufacture of a medicament for the treatment of secondary nerve cell damages and function disorders after head-brain-traumata | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-02-24 | — | — | EP | disclosed |
| US-5173492-A | Bronchodilator agents | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1992-12-22 | — | — | US | disclosed |
| EP-0423805-A2 | Condensed purine derivatives | KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) | 1991-04-24 | — | — | EP | disclosed |
| EP-0417790-A2 | S-triazolo[3,4-i]purine derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1991-03-20 | — | — | EP | disclosed |
| EP-0369744-A2 | Xanthine derivatives, process for their preparation and pharmaceutical compositions | SMITHKLINE BEECHAM PHARMA GmbH (DE) | 1990-05-23 | — | — | EP | disclosed |
| EP-0319854-A2 | Process for the methylation of xanthins | BOEHRINGER INGELHEIM KG (DE) | 1989-06-14 | — | — | EP | disclosed |
| EP-0260127-A2 | Xanthine derivatives, their preparation and pharmaceutical compositions containing them | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1988-03-16 | — | — | EP | disclosed |