Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 2/20 | 0.30 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL14264356 | 0.88 | GSTO1 (0.34) | — | |
| SCHEMBL14264348 | 0.85 | — | — | |
| SCHEMBL14264389 | 0.85 | — | — | |
| SCHEMBL14264354 | 0.84 | CYP11B1 (0.36) | — | |
| SCHEMBL14264358 | 0.83 | — | — | |
| SCHEMBL14255381 | 0.83 | DRD3 (0.33) | HTR2AHTR2CHTR2BBACE1 | |
| SCHEMBL14264359 | 0.82 | EPHX2 (0.33) | — | |
| SCHEMBL14264352 | 0.82 | — | — | |
| SCHEMBL14264357 | 0.80 | TRPV4 (0.33) | — | |
| SCHEMBL14264351 | 0.78 | — | — |
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-7344761-B2 | Liquid-crystalline compounds | MERCK PATENT GESELLASCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2008-03-18 | — | — | US | disclosed |