Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 4/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.34 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.34 |
| ▸ | USP7 | Q93009 | 2/20 | 0.33 |
| ▸ | CLK2 | P49760 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7701750 | 1.00 | CDK5 (0.36) | CDK5CDK5R1CHRNB4CHRNA3PRKCZ | |
| SCHEMBL5848974 | 0.87 | CHRNB2 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL5849392 | 0.87 | CHRNB2 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL5848969 | 0.87 | CHRNB2 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL7689822 | 0.84 | GRM5 (0.47) | CHRNB4CHRNA3CYP11B1CYP11B2CHRNB2 | |
| SCHEMBL7689824 | 0.84 | GRM5 (0.47) | CHRNB4CHRNA3CYP11B1CYP11B2CHRNB2 | |
| SCHEMBL5848829 | 0.82 | LTA4H (0.42) | CHRNB2CHRNA4 | |
| SCHEMBL5849286 | 0.82 | CHRNB4 (0.39) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL5849278 | 0.82 | CHRNB4 (0.39) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL5848891 | 0.76 | CHRNA3 (0.43) | CHRNB4CHRNA3CHRNB2CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002088114-A2 | HETEROARYL OFEFINIC AZACYCLIC AND HETEROARYL ACETYLENIC AZACYCLIC COMPOUNDS FOR THE TREATMENT OF CNS DISORDERS | TARGACEPT, INC. (US) | 2002-11-07 | — | — | WO | claimed |