Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 4/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SHBG | P04278 | 1/20 | 0.30 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3517534 | 0.93 | CYP3A4 (0.38) | CYP3A4SMN1; SMN2PPARAPPARGMEN1 | |
| SCHEMBL9345885 | 0.83 | CYP3A4 (0.33) | CYP3A4SMN1; SMN2PPARAPPARG | |
| SCHEMBL11365688 | 0.83 | SHBG (0.50) | CYP3A4SMN1; SMN2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL899654 | 0.82 | RIPK1 (0.41) | SLC6A2PPARAPPARGRIPK1TSHR | |
| SCHEMBL26746 | 0.80 | SLC6A2 (0.44) | CYP3A4SLC6A2SLC6A4SLC6A3KIF11 | |
| SCHEMBL24575665 | 0.79 | TSHR (0.36) | CYP3A4SLC6A2SLC6A4SLC6A3KIF11 | |
| SCHEMBL9115553 | 0.78 | CYP3A4 (0.30) | CYP3A4SMN1; SMN2 | |
| SCHEMBL13019868 | 0.78 | CYP3A4 (0.58) | CYP3A4SMN1; SMN2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20090430 | 0.78 | ALDH1A1 (0.48) | SMN1; SMN2MEN1KMT2AKDM4EMAPT | |
| SCHEMBL3294363 | 0.78 | CYP3A4 (0.31) | CYP3A4SMN1; SMN2 |
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-1695685-B1 | ONE-PART DENTAL ADHESIVE COMPOSITION | KURARAY NORITAKE DENTAL INC (JP) | 2012-11-07 | — | — | EP | disclosed |