Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL28052348 | 0.81 | POLB (0.39) | RAB9AALDH1A1POLBGAAHPGD | |
| SCHEMBL28052307 | 0.77 | CA2 (0.33) | SMN1; SMN2LMNARAB9AMAPTHTT | |
| SCHEMBL28052144 | 0.76 | TAAR1 (0.33) | CYP3A4CYP1A2CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL20767517 | 0.76 | FAAH (0.43) | CYP3A4CYP2D6CYP2C19ALDH1A1KDM4E | |
| SCHEMBL9310748 | 0.75 | TLR2 (0.41) | CYP3A4SMN1; SMN2LMNAALDH1A1POLB | |
| SCHEMBL6056483 | 0.75 | TLR2 (0.41) | CYP3A4SMN1; SMN2ALDH1A1KMT2AMEN1 | |
| SCHEMBL16511038 | 0.73 | ALDH1A1 (0.47) | CYP3A4SMN1; SMN2LMNAALDH1A1POLB | |
| SCHEMBL9310507 | 0.72 | TLR2 (0.39) | CYP3A4SMN1; SMN2LMNAALDH1A1POLB | |
| SCHEMBL6390242 | 0.71 | USP2 (0.49) | CYP3A4CYP1A2CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL1408676 | 0.70 | CYP2C9 (0.41) | CYP3A4CYP1A2CYP2D6CYP2C19SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-105315181-A | Synthetic method for sulfo trisubstituted alkenes compound | UNIV HUNAN | 2016-02-10 | — | — | CN | disclosed |