Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 10/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 3/20 | 0.41 |
| ▸ | CCND1 | P24385 | 3/20 | 0.41 |
| ▸ | REN | P00797 | 2/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL91358 | 0.83 | HTR2A (0.51) | MCL1HTR2AHTR2CGLO1CDK4 | |
| SCHEMBL13962823 | 0.82 | MCL1 (0.46) | MCL1HTR2AHTR2CGLO1CDK4 | |
| SCHEMBL8265371 | 0.82 | MCL1 (0.46) | MCL1HTR2AHTR2CGLO1CDK4 | |
| SCHEMBL1049671 | 0.82 | HTR7 (0.51) | MCL1HTR2AHTR2CGLO1CDK4 | |
| SCHEMBL13131405 | 0.81 | HTR7 (0.52) | MCL1HTR2AHTR2CGLO1CDK4 | |
| SCHEMBL78479 | 0.79 | HTR7 (0.53) | MCL1HTR2AHTR2CGLO1CDK4 | |
| SCHEMBL13962820 | 0.78 | ALDH1A1 (0.38) | MCL1 | |
| SCHEMBL31083788 | 0.78 | CDK4 (0.70) | HTR2AHTR2CGLO1CDK4CCND1 | |
| SCHEMBL3995842 | 0.78 | CDK4 (0.70) | HTR2AHTR2CGLO1CDK4CCND1 | |
| SCHEMBL2930757 | 0.77 | MCL1 (0.67) | MCL1GLO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1717226-B1 | 2,7-SUBSTITUTED 5-AMINO-4-HYDROXY-8-(1H-INDOL-5-YL)-OCTAN AMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION | SPEEDEL EXPERIMENTA AG (CH) | 2009-01-21 | — | — | EP | disclosed |