Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.57 |
| ▸ | ERN1 | O75460 | 3/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.43 |
| ▸ | TUBB | P07437 | 3/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.43 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.43 |
| ▸ | TUBA1C | Q9BQE3 | 3/20 | 0.43 |
| ▸ | TUBB6 | Q9BUF5 | 3/20 | 0.43 |
| ▸ | TUBB2B | Q9BVA1 | 3/20 | 0.43 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27624039 | 0.85 | P2RY14 (0.52) | CNR2ERN1HDAC2ADORA3ADORA2A | |
| SCHEMBL27605040 | 0.84 | CNR2 (0.55) | CNR2ERN1HDAC2SERPINE1CNR1 | |
| SCHEMBL15650192 | 0.83 | DHODH (0.43) | CNR2ERN1HDAC2ADORA3ADORA2A | |
| SCHEMBL5737770 | 0.83 | ADORA2A (0.46) | CNR2ERN1TUBB4ATUBBTUBA3C | |
| SCHEMBL27735342 | 0.83 | CNR2 (0.42) | CNR2ERN1TUBB4ATUBBTUBA3C | |
| SCHEMBL27605393 | 0.78 | CNR2 (0.53) | CNR2ERN1HDAC2ADORA3ADORA2A | |
| SCHEMBL27605041 | 0.78 | CNR2 (0.49) | CNR2ERN1TUBB4ATUBBTUBA3C | |
| SCHEMBL8442653 | 0.75 | P2RY14 (0.58) | CNR2ERN1HDAC2ADORA3ADORA2A | |
| SCHEMBL28183119 | 0.75 | CA12 (0.50) | — | |
| SCHEMBL419097 | 0.75 | KMO (0.61) | CNR2ERN1HDAC2P2RY14SERPINE1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100343256-C | Biaryl substituted diazabicycloalkane amides as nicotinic acetylcholine agonists | ASTRAZENECA AB (SE) | 2007-10-17 | — | — | CN | claimed |
| CN-1678615-A | Biaryl substituted diazabicycloalkanes as nicotinic acetylcholine antagonists | ASTRAZENECA AB (SE) | 2005-10-05 | — | — | CN | claimed |
| CN-102209540-A | Treatment with alpha a7-selective ligands | TARGACEPT INC | 2011-10-05 | — | — | CN | disclosed |
| CN-101868237-A | Be used for the treatment of or prevent the alpha 7 nAChR agonists of metabolism disorder | TARGACEPT INC | 2010-10-20 | — | — | CN | disclosed |
| CN-100343256-C | Biaryl substituted diazabicycloalkane amides as nicotinic acetylcholine agonists | ASTRAZENECA AB (SE) | 2007-10-17 | — | — | CN | disclosed |
| CN-1678615-A | Biaryl substituted diazabicycloalkanes as nicotinic acetylcholine antagonists | ASTRAZENECA AB (SE) | 2005-10-05 | — | — | CN | disclosed |