Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 12/20 | 0.53 |
| ▸ | HTR2B | P41595 | 12/20 | 0.53 |
| ▸ | HTR2A | P28223 | 10/20 | 0.53 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LIPE | Q05469 | 2/20 | 0.39 |
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4465494 | 1.00 | HTR2C (0.53) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4472443 | 1.00 | HTR2C (0.53) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4472830 | 1.00 | HTR2C (0.53) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4466443 | 1.00 | HTR2C (0.53) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4465496 | 1.00 | HTR2C (0.53) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4473399 | 0.86 | HTR2A (0.50) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4473401 | 0.86 | HTR2A (0.50) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4475150 | 0.86 | HTR2A (0.50) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4468054 | 0.85 | HTR2A (0.49) | HTR2CHTR2BHTR2ARORCKDM4E | |
| SCHEMBL4483866 | 0.85 | HTR2A (0.49) | HTR2CHTR2BHTR2ARORCKDM4E |
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 |