Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.71 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.36 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25557425 | 1.00 | ALOX15 (0.71) | ALOX15PTPN1ALDH1A1TSHRCHRM5 | |
| SCHEMBL8007900 | 0.87 | ALOX15 (0.56) | ALOX15PTPN1ALDH1A1TSHR | |
| SCHEMBL7552905 | 0.85 | ALOX15 (0.70) | ALOX15PTPN1ALDH1A1TSHRCHRM5 | |
| Citronellyl Acetate SCHEMBL20912959 | 0.83 | ALOX15 (1.00) | ALOX15PTPN1ALDH1A1TSHRUSP2 | |
| SCHEMBL7583479 | 0.83 | ALOX15 (0.69) | ALOX15PTPN1ALDH1A1TSHRCHRM5 | |
| Citronellyl Acetate SCHEMBL157075 | 0.83 | ALOX15 (1.00) | ALOX15PTPN1ALDH1A1TSHRUSP2 | |
| Citronellyl Acetate SCHEMBL1866109 | 0.83 | ALOX15 (1.00) | ALOX15PTPN1ALDH1A1TSHRUSP2 | |
| SCHEMBL1614306 | 0.82 | ALOX15 (0.58) | ALOX15PTPN1ALDH1A1TSHRCHRM5 | |
| SCHEMBL1300963 | 0.82 | ALOX15 (0.73) | ALOX15PTPN1ALDH1A1TSHRCHRM5 | |
| SCHEMBL1300960 | 0.82 | ALOX15 (0.73) | ALOX15PTPN1ALDH1A1TSHRCHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000024358-A2 | SYNTHESIS AND USES OF THIOPENTONE ENANTIOMERS | THE UNIVERSITY OF SYDNEY (AU) | 2000-05-04 | — | — | WO | disclosed |