Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | GPR6 | P46095 | 8/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.32 |
| ▸ | WHR1 | P49842 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL194767 | 0.93 | CCNA2 (0.35) | CCNA2CDK2CCNA1CDK5DYRK1A | |
| SCHEMBL7719378 | 0.93 | CCNA2 (0.35) | CCNA2CDK2CCNA1CDK5DYRK1A | |
| Trifluoroacetic Acid SCHEMBL15808556 | 0.91 | SLC2A1 (0.35) | CYP11B2GPR6WHR1 | |
| SCHEMBL17019875 | 0.89 | GPR6 (0.31) | GPR6 | |
| Trifluoroacetic Acid SCHEMBL17019868 | 0.84 | CYP11B2 (0.32) | CYP11B2WHR1 | |
| Trifluoroacetic Acid SCHEMBL17019864 | 0.84 | SORD (0.34) | CYP11B2GPR6CCNA2CDK2CCNA1 | |
| SCHEMBL7715595 | 0.83 | CCNA2 (0.33) | CCNA2CDK2CCNA1CDK5DYRK1A | |
| SCHEMBL194327 | 0.83 | CCNA2 (0.33) | CCNA2CDK2CCNA1CDK5DYRK1A | |
| Trifluoroacetic Acid SCHEMBL17019859 | 0.82 | HSP90AA1 (0.32) | CYP11B2GPR6 | |
| Trifluoroacetic Acid SCHEMBL16924600 | 0.81 | DPP4 (0.31) | CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9115142-B2 | Heterocycle-substituted piperazino-dihydrothienopyrimidines | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2015-08-25 | — | — | US | disclosed |