Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | COMT | P21964 | 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 | |
|---|---|---|---|---|
| SCHEMBL28484764 | 0.84 | AKT2 (0.36) | ALDH1A1ESR1CYP3A4ESR2COMT | |
| SCHEMBL28453550 | 0.82 | TRPA1 (0.31) | — | |
| SCHEMBL30027744 | 0.81 | KIF11 (0.36) | ALDH1A1ESR1CYP3A4ESR2COMT | |
| SCHEMBL8763762 | 0.80 | ALDH1A1 (0.31) | ALDH1A1ESR1CYP3A4ESR2 | |
| SCHEMBL6528134 | 0.77 | TRPA1 (0.33) | ALDH1A1ESR1CYP3A4ESR2COMT | |
| SCHEMBL9850897 | 0.76 | TRPA1 (0.33) | — | |
| SCHEMBL27537520 | 0.75 | AKT2 (0.39) | ALDH1A1 | |
| SCHEMBL28343620 | 0.75 | ALDH1A1 (0.32) | ALDH1A1ESR1CYP3A4ESR2COMT | |
| Benzotriazole SCHEMBL27781031 | 0.69 | CYP3A4 (0.41) | ALDH1A1ESR1CYP3A4ESR2COMT | |
| SCHEMBL31570217 | 0.69 | ESR1 (0.34) | ALDH1A1ESR1CYP3A4ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1238003-A1 | MONO- AND BIS- BENZOTRIAZOLYLDIHYDROXYBIARYL UV ABSORBERS | CYTEC TECHNOLOGY CORP. (US) | 2002-09-11 | — | — | EP | disclosed |
| US-6344505-B1 | Mono- and bis-benzotriazolyldihydroxybiaryl UV absorbers | CYTEC INDUSTRIES INC. | 2002-02-05 | — | — | US | disclosed |
| WO-2001034694-A1 | MONO- AND BIS- BENZOTRIAZOLYLDIHYDROXYBIARYL UV ABSORBERS | CYTEC TECHNOLOGY CORP. (US) | 2001-05-17 | — | — | WO | disclosed |