Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL2110694 | 0.79 | APEX1 (0.32) | APEX1HTR2AHTR2CHTR2BS1PR1 | |
| SCHEMBL10199960 | 0.79 | HTR2A (0.37) | APEX1HTR2AHTR2CHTR2BS1PR1 | |
| SCHEMBL10200081 | 0.79 | CDK7 (0.37) | APEX1HTR2AHTR2CHTR2BS1PR1 | |
| Hydrochloric Acid SCHEMBL2112542 | 0.78 | HTR2A (0.36) | APEX1HTR2AHTR2CHTR2BS1PR1 | |
| Hydrochloric Acid SCHEMBL2111829 | 0.78 | CDK7 (0.36) | APEX1HTR2AHTR2CHTR2BS1PR1 | |
| Hydrochloric Acid SCHEMBL2111995 | 0.78 | APEX1 (0.31) | APEX1HTR2AHTR2CHTR2B | |
| SCHEMBL10200739 | 0.76 | HTR2C (0.35) | HTR2CHTR2BS1PR1 | |
| SCHEMBL2109252 | 0.76 | S1PR1 (0.35) | APEX1S1PR1 | |
| SCHEMBL10200689 | 0.76 | NCF1 (0.32) | S1PR1 | |
| SCHEMBL2110517 | 0.76 | HTR2C (0.32) | HTR2CHTR2B |
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-2213675-A1 | PYRIDOOXAZEPINE DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-08-04 | — | — | EP | disclosed |