Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | TACR2 | P21452 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TST | Q16762 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9766501 | 0.88 | CHRNB2 (0.35) | KDM4ESMN1; SMN2 | |
| SCHEMBL1532805 | 0.85 | ESR1 (0.43) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL28350462 | 0.82 | CYP1A2 (0.43) | FDFT1 | |
| SCHEMBL27757380 | 0.81 | TAAR1 (0.42) | ALDH1A1KDM4EPTGS1PTGS2SIGMAR1 | |
| SCHEMBL10605113 | 0.81 | MAOB (0.48) | ALDH1A1CYP3A4HTR2ASIGMAR1 | |
| SCHEMBL16523045 | 0.81 | ALDH1A1 (0.37) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL21131657 | 0.81 | PPARA (0.44) | SLC6A2SLC6A3 | |
| SCHEMBL105717 | 0.81 | ESR1 (0.55) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL107901 | 0.80 | SIGMAR1 (0.47) | ADRA2ASLC6A2SLC6A4SLC6A3CHRM2 | |
| SCHEMBL9766497 | 0.79 | FDFT1 (0.34) | ESR1ADRA2AADORA3TACR2SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5034152-A | Liquid crystal 4-alkylbenzenethiols, ferroelectricity | CANON KABUSHIKI KAISHA (JP) | 1991-07-23 | — | — | US | claimed |
| US-5034152-A | Liquid crystal 4-alkylbenzenethiols, ferroelectricity | CANON KABUSHIKI KAISHA (JP) | 1991-07-23 | — | — | US | disclosed |
| US-4816178-A | Optically active compound and liquid crystal composition containing same | CANON KABUSHIKI KAISHA (JP) | 1989-03-28 | — | — | US | disclosed |