Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 3/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.41 |
| ▸ | HCN4 | Q9Y3Q4 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | FKBP1A | P62942 | 5/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | FKBP4 | Q02790 | 1/20 | 0.38 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9739274 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3CHRNB2CHRNA4PDE4D | |
| SCHEMBL9215863 | 0.95 | BRD4 (0.40) | CHRNB4CHRNA3CHRNB2CHRNA4PDE4D | |
| SCHEMBL9212245 | 0.90 | CHRNB4 (0.43) | CHRNB4CHRNA3CHRNB2CHRNA4PDE4D | |
| Hydrochloric Acid SCHEMBL9739435 | 0.89 | CHRNB4 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4PDE4D | |
| SCHEMBL9210508 | 0.88 | CCR2 (0.37) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL9741720 | 0.86 | CCR2 (0.36) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL9213548 | 0.84 | PDE5A (0.37) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL9214021 | 0.84 | CHRNB4 (0.43) | CHRNB4CHRNA3CHRNB2CHRNA4PDE4D | |
| SCHEMBL9738909 | 0.82 | BCHE (0.44) | PDE4DBRD4 | |
| SCHEMBL9209351 | 0.81 | CHRNB4 (0.46) | CHRNB4CHRNA3CHRNB2CHRNA4PDE4D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |