Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 18/20 | 0.61 |
| ▸ | HTR2C | P28335 | 18/20 | 0.61 |
| ▸ | HTR2B | P41595 | 18/20 | 0.61 |
| ▸ | DPP4 | P27487 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4472753 | 0.91 | HTR2A (0.62) | HTR2AHTR2CHTR2BDPP4 | |
| SCHEMBL4459349 | 0.87 | HTR2A (0.46) | HTR2AHTR2CHTR2B | |
| SCHEMBL4484134 | 0.87 | HTR2A (0.60) | HTR2AHTR2CHTR2B | |
| SCHEMBL4461280 | 0.86 | HTR2A (0.45) | HTR2AHTR2CHTR2B | |
| SCHEMBL4471097 | 0.85 | HTR2A (0.44) | HTR2AHTR2CHTR2B | |
| SCHEMBL4475909 | 0.85 | HTR2A (0.54) | HTR2AHTR2CHTR2B | |
| SCHEMBL4475914 | 0.85 | HTR2A (0.54) | HTR2AHTR2CHTR2B | |
| SCHEMBL4465996 | 0.85 | HTR2A (0.58) | HTR2AHTR2CHTR2B | |
| SCHEMBL4475182 | 0.84 | HTR2A (0.63) | HTR2AHTR2CHTR2B | |
| SCHEMBL13756910 | 0.83 | HTR2A (0.66) | HTR2AHTR2CHTR2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1778225-A2 | PYRROLO(OXO)ISOQUINOLINES AS 5HT LIGANDS | Bristol-Myers Squibb Company (US) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006019886-A2 | PYRROLO(OXO)ISOQUINOLINES AS 5HT LIGANDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-02-23 | — | — | WO | disclosed |