Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.34 |
| ▸ | USP5 | P45974 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8517389 | 1.00 | ESR2 (0.36) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL8517390 | 1.00 | ESR2 (0.36) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9136412 | 0.96 | ESR2 (0.34) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9136818 | 0.96 | ESR2 (0.34) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL17070829 | 0.91 | HTR2A (0.37) | CCR2HTR2AHTR2CHTR2BUSP30 | |
| SCHEMBL8037067 | 0.89 | ESR2 (0.36) | ESR2CCR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL8037065 | 0.89 | ESR2 (0.36) | ESR2CCR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL8037070 | 0.89 | ESR2 (0.36) | ESR2CCR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL9253959 | 0.88 | ESR2 (0.36) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9253972 | 0.88 | ESR2 (0.36) | ESR2CCR2HTR2AHTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0475273-B1 | Liquid crystal mixture containing halogenated alcenyl compounds | MERCK PATENT GMBH (DE) | 1999-04-07 | — | — | EP | disclosed |
| EP-0475273-A1 | Halogenated alcenyl compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1992-03-18 | — | — | EP | disclosed |