Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.31 |
| ▸ | USP5 | P45974 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9312461 | 1.00 | CYP2C9 (0.35) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8517972 | 1.00 | CYP2C9 (0.35) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8517973 | 1.00 | CYP2C9 (0.35) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL4921898 | 0.93 | HTR2A (0.36) | CCR2HTR2AHTR2CHTR2BUSP30 | |
| SCHEMBL8518689 | 0.90 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL9311979 | 0.90 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8518687 | 0.90 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8518684 | 0.90 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL9254740 | 0.90 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL14316105 | 0.89 | USP5 (0.34) | CCR2HTR2AHTR2CHTR2BUSP30 |
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-5292452-A | Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time | HOFFMANN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |