Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11013263 | 1.00 | CYP2C19 (0.44) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL245863 | 0.80 | CYP2C19 (0.58) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL5776904 | 0.79 | ALDH1A1 (0.50) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL10606675 | 0.76 | TAAR1 (0.50) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL6442351 | 0.76 | TAAR1 (0.50) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL10382468 | 0.76 | TAAR1 (0.50) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL17914194 | 0.75 | CHRM2 (0.44) | CYP2C19HIF1AKDM4ECYP3A4KMT2A | |
| SCHEMBL7040834 | 0.74 | CYP2C19 (0.52) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL11864443 | 0.73 | CYP2C19 (0.43) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 | |
| SCHEMBL4002340 | 0.73 | ALDH1A1 (0.43) | CYP2C19HIF1AKDM4EALDH1A1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0049543-B1 | PERFUME COMPOSITIONS AND PERFUMED MATERIALS AND ARTICLES, CONTAINING PHENYL-TETRAHYDROFURANS AS A FRAGRANCE | NAARDEN INTERNATIONAL N.V. (NL) | 1985-03-20 | — | — | EP | disclosed |