Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.32 |
| ▸ | USP5 | P45974 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9312059 | 1.00 | ESR2 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9312054 | 1.00 | ESR2 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL8517429 | 1.00 | ESR2 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL8517430 | 1.00 | ESR2 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9136802 | 0.96 | ESR2 (0.33) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9138202 | 0.96 | ESR2 (0.33) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL17070830 | 0.91 | HTR2A (0.35) | HTR2AHTR2CHTR2BUSP30HCRTR2 | |
| SCHEMBL8518665 | 0.88 | OPRL1 (0.34) | ESR2CYP2C9OPRL1 | |
| SCHEMBL8518672 | 0.88 | OPRL1 (0.34) | ESR2CYP2C9OPRL1 | |
| SCHEMBL8518671 | 0.88 | OPRL1 (0.34) | ESR2CYP2C9OPRL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0475273-B1 | Liquid crystal mixture containing halogenated alcenyl compounds | MERCK PATENT GMBH (DE) | 1999-04-07 | — | — | EP | disclosed |
| US-5292452-A | Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time | HOFFMANN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0475273-A1 | Halogenated alcenyl compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1992-03-18 | — | — | EP | disclosed |