Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 19/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | FAP | Q12884 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL497449 | 0.84 | DPP4 (0.50) | DPP4KCNH2KMT2A | |
| SCHEMBL9290262 | 0.83 | DPP4 (0.51) | DPP4KCNH2CHRM1FAP | |
| SCHEMBL3919809 | 0.83 | DPP4 (0.68) | DPP4KCNH2FAP | |
| SCHEMBL638215 | 0.83 | DPP4 (0.55) | DPP4KCNH2CHRM1FAP | |
| SCHEMBL4487837 | 0.83 | KMT2A (0.60) | DPP4KMT2A | |
| SCHEMBL3918551 | 0.82 | DPP4 (0.51) | DPP4CHRM1FAP | |
| SCHEMBL9290265 | 0.82 | DPP4 (0.49) | DPP4KCNH2CHRM1FAP | |
| SCHEMBL8273211 | 0.82 | DPP4 (0.49) | DPP4KCNH2CHRM1FAP | |
| SCHEMBL3975825 | 0.80 | DPP4 (0.84) | DPP4CHRM1FAP | |
| SCHEMBL3975831 | 0.80 | DPP4 (0.84) | DPP4CHRM1FAP |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7550455-B2 | 8-(piperazin-1yl)- and 8-([1,4]diazepan-1yl)-xanthines, the preparation thereof and their use as pharmaceutical composition | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-06-23 | — | — | US | disclosed |