Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 4/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9904024 | 0.88 | DCTPP1 (0.54) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904130 | 0.88 | ADORA2B (0.55) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904138 | 0.86 | ADORA2B (0.63) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904105 | 0.84 | ADORA2B (0.65) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904155 | 0.83 | ADORA2B (0.48) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904184 | 0.82 | ADORA2B (0.51) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904014 | 0.81 | PTGS2 (0.45) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9943740 | 0.80 | ADORA2B (0.53) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL25090654 | 0.80 | ADORA2B (0.70) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9904114 | 0.78 | MAPT (0.57) | ADORA2BADORA2AADORA3ADORA1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2649045-A2 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | Bayer Intellectual Property GmbH (DE) | 2013-10-16 | — | — | EP | disclosed |
| EP-2465859-A1 | 8-Triazolylxanthine derivatives, processes for their production and their use as adenosine receptor antagonists | Life & Brain GmbH (DE) | 2012-06-20 | — | — | EP | disclosed |
| WO-2012076466-A2 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-06-14 | — | — | WO | disclosed |
| WO-2012076974-A1 | 8-TRIAZOLYLXANTHINE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND THEIR USE AS ADENOSINE RECEPTOR ANTAGONISTS | LIFE & BRAIN GMBH (DE) | 2012-06-14 | — | — | WO | disclosed |