Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TLR4 | O00206 | 2/20 | 0.39 |
| ▸ | TLR2 | O60603 | 2/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14397231 | 0.90 | ALDH1A1 (0.49) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL12852056 | 0.90 | ALDH1A1 (0.49) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL14397530 | 0.83 | ALDH1A1 (0.45) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL5817830 | 0.81 | GRM2 (0.44) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL5749654 | 0.80 | DRD2 (0.48) | — | |
| SCHEMBL12855128 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL24936395 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL5819818 | 0.72 | KDM4E (0.40) | PARP15PARP10 | |
| SCHEMBL14817248 | 0.72 | PARP15 (0.43) | PARP15PARP10 | |
| SCHEMBL12730750 | 0.71 | PARP15 (0.39) | PARP15PARP10 |
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-3327091-A1 | EPOXY FUNCTIONAL COMPOSITION PROTECTING DYES FROM PHOTO-DEGRADATION AND CURED COATINGS PREPARED THEREFROM | Essilor International (FR) | 2018-05-30 | — | — | EP | disclosed |