Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 20/20 | 0.68 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | FAP | Q12884 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3968666 | 0.90 | DPP4 (0.59) | DPP4CYP3A4FAP | |
| SCHEMBL3971177 | 0.88 | DPP4 (0.55) | DPP4CYP3A4FAP | |
| SCHEMBL3975250 | 0.87 | DPP4 (0.58) | DPP4KCNH2CYP3A4 | |
| SCHEMBL3972320 | 0.83 | DPP4 (0.59) | DPP4CYP3A4FAP | |
| SCHEMBL3970492 | 0.83 | DPP4 (0.56) | DPP4CYP3A4FAP | |
| SCHEMBL3969414 | 0.82 | DPP4 (0.52) | DPP4CYP3A4FAP | |
| SCHEMBL3970690 | 0.81 | DPP4 (0.55) | DPP4FAP | |
| SCHEMBL4225060 | 0.81 | DPP4 (1.00) | DPP4KCNH2CYP3A4 | |
| SCHEMBL4225063 | 0.81 | DPP4 (1.00) | DPP4KCNH2CYP3A4 | |
| Hydrochloric Acid SCHEMBL4221529 | 0.80 | DPP4 (0.98) | DPP4KCNH2CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7569574-B2 | Purine derivatives, the preparation thereof and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2009-08-04 | — | — | US | disclosed |
| EP-1532150-B1 | NOVEL PURINE DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA (DE) | 2008-06-11 | — | — | EP | disclosed |
| EP-1532150-A1 | NOVEL PURINE DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004018469-A1 | NOVEL PURINE DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2004-03-04 | — | — | WO | disclosed |