Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 6/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.35 |
| ▸ | CDK9 | P50750 | 3/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 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 | |
|---|---|---|---|---|
| SCHEMBL4250880 | 1.00 | HTR2C (0.40) | HTR2CCCNT1CDK9AHRCRHR1 | |
| SCHEMBL13627329 | 0.85 | HTR2C (0.42) | HTR2CAHR | |
| SCHEMBL4469750 | 0.85 | HTR2C (0.42) | HTR2CAHR | |
| SCHEMBL13627320 | 0.80 | CYP1A1 (0.35) | HTR2C | |
| SCHEMBL4479389 | 0.80 | CYP1A1 (0.35) | HTR2C | |
| SCHEMBL4486316 | 0.80 | CYP1A1 (0.35) | HTR2C | |
| SCHEMBL4250357 | 0.79 | HTR2C (0.38) | HTR2C | |
| SCHEMBL13627312 | 0.79 | HTR2C (0.38) | HTR2C | |
| SCHEMBL13627313 | 0.76 | TRPA1 (0.36) | HTR2C | |
| SCHEMBL4472523 | 0.76 | TRPA1 (0.36) | HTR2C |
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-7618980-B2 | Pyrrolo(oxo)quinolines as 5HT ligands | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-17 | — | — | US | disclosed |