Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 4/20 | 0.36 |
| ▸ | HTR2C | P28335 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | PELI1 | Q96FA3 | 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 | |
|---|---|---|---|---|
| SCHEMBL1719173 | 0.78 | TRPA1 (0.41) | TRPA1HTR2AHTR2CKCNH2DHFR | |
| (Z)-1,2-Diphenylethene SCHEMBL28122368 | 0.74 | TRPA1 (0.40) | TRPA1HTR2AHTR2CKCNH2DHFR | |
| SCHEMBL157941 | 0.74 | TRPA1 (0.40) | TRPA1HTR2AHTR2CKCNH2DHFR | |
| SCHEMBL7590546 | 0.72 | PELI1 (0.40) | TRPA1HTR2AHTR2CKCNH2NFE2L2 | |
| SCHEMBL722164 | 0.72 | TRPA1 (0.44) | TRPA1DHFRNFE2L2CYP19A1MAOA | |
| SCHEMBL29413345 | 0.72 | TRPA1 (0.44) | TRPA1DHFRNFE2L2CYP19A1MAOA | |
| SCHEMBL285312 | 0.71 | TRPA1 (0.47) | TRPA1HTR2AHTR2CKCNH2NFE2L2 | |
| SCHEMBL2528153 | 0.71 | TRPA1 (0.47) | TRPA1HTR2AHTR2CKCNH2NFE2L2 | |
| SCHEMBL8076471 | 0.71 | TRPA1 (0.43) | TRPA1HTR2AHTR2CKCNH2DHFR | |
| SCHEMBL8076468 | 0.71 | TRPA1 (0.43) | TRPA1DHFRNFE2L2CYP19A1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001092217-A3 | PROCESS FOR THE PREPARATION OF AMIDOSTYRYLSTILBENE-DISULPHONIC ACID COMPOUNDS AND NOVEL AMIDOSTYRYLSTILBENE-DISULPHONIC ACID COMPOUNDS AND THEIR USE AS FLUORESCENT WHITENING AGENTS | CIBA SC HOLDING AG (CH) | 2002-05-16 | — | — | WO | disclosed |
| WO-2001092217-A2 | PROCESS FOR THE PREPARATION OF AMIDOSTYRYLSTILBENE-DISULPHONIC ACID COMPOUNDS AND NOVEL AMIDOSTYRYLSTILBENE-DISULPHONIC ACID COMPOUNDS AND THEIR USE AS FLUORESCENT WHITENING AGENTS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2001-12-06 | — | — | WO | disclosed |
| WO-2001092217-A2 | PROCESS FOR THE PREPARATION OF AMIDOSTYRYLSTILBENE-DISULPHONIC ACID COMPOUNDS AND NOVEL AMIDOSTYRYLSTILBENE-DISULPHONIC ACID COMPOUNDS AND THEIR USE AS FLUORESCENT WHITENING AGENTS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2001-12-06 | — | — | WO | disclosed |