Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL831629 | 0.83 | ADORA2B (0.44) | ADORA2BALDH1A1HTT | |
| SCHEMBL3708335 | 0.76 | ADORA2B (0.34) | ADORA2BALDH1A1 | |
| SCHEMBL9188539 | 0.66 | ADORA2B (0.46) | ADORA2BALDH1A1HTT | |
| SCHEMBL833090 | 0.66 | ADORA2B (0.44) | ADORA2BALDH1A1HTT | |
| SCHEMBL3710229 | 0.63 | ADORA2B (0.39) | ADORA2BALDH1A1HTT | |
| SCHEMBL20578322 | 0.62 | ADORA2B (0.36) | ADORA2BALDH1A1HTT | |
| SCHEMBL9726284 | 0.61 | KDM4E (0.62) | ADORA2BALDH1A1HTT | |
| SCHEMBL5560191 | 0.60 | KDM4E (0.56) | ALDH1A1HTT | |
| SCHEMBL9726351 | 0.60 | ADORA2B (0.45) | ADORA2BALDH1A1HTT | |
| SCHEMBL9690795 | 0.58 | KDM4E (0.45) | ALDH1A1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2197846-A1 | SUBSTITUTED 6-PHEYLNICOTINIC ACIDS AND THE USE THEREOF | Bayer Animal Health GmbH (DE) | 2010-06-23 | — | — | EP | disclosed |
| WO-2009033561-A1 | SUBSTITUTED 6-PHEYLNICOTINIC ACIDS AND THE USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-19 | — | — | WO | disclosed |