Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9419092 | 0.86 | ESR2 (0.43) | HTR2AHTR2CHTR2BESR1ESR2 | |
| SCHEMBL23923588 | 0.78 | HTR2A (0.56) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL23923444 | 0.78 | HTR2A (0.56) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL23923443 | 0.78 | HTR2A (0.56) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL30317799 | 0.78 | HTR2A (0.56) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL23940041 | 0.78 | HTR2A (0.56) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL30317790 | 0.78 | HTR2A (0.56) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| Ammonia Solution, Strong SCHEMBL266151 | 0.77 | HTR2A (0.54) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL21066331 | 0.71 | KDM1A (0.66) | HTR2AHTR2CHTR2BCHRNB4CHRNA3 | |
| SCHEMBL6294315 | 0.70 | HTR2A (0.42) | HTR2AHTR2CHTR2BESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5367079-A | Lipoxygenase inhibitors; antiinflammatory agents, antiallergens | ZENECA LIMITED (GB) | 1994-11-22 | — | — | US | disclosed |
| EP-0570112-A1 | Cycloalkane derivatives | ZENECA LIMITED (GB) | 1993-11-18 | — | — | EP | disclosed |