Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | PTPN11 | Q06124 | 6/20 | 0.52 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.52 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27733996 | 0.98 | ALDH1A1 (0.58) | ALDH1A1PTPN11S1PR3CYP1A2CYP2D6 | |
| SCHEMBL4612211 | 0.97 | ALDH1A1 (0.63) | ALDH1A1PTPN11S1PR3CYP1A2CYP2D6 | |
| SCHEMBL730027 | 0.91 | ALDH1A1 (0.63) | ALDH1A1S1PR3CYP1A2CYP2D6SCN1A | |
| SCHEMBL9363457 | 0.86 | PTPN11 (0.57) | ALDH1A1PTPN11S1PR3CYP1A2CYP2D6 | |
| SCHEMBL28193088 | 0.84 | PTPN11 (0.66) | ALDH1A1PTPN11TP53TSHRPLA2G4B | |
| SCHEMBL578910 | 0.84 | ALDH1A1 (0.67) | ALDH1A1CYP1A2CYP2D6SCN1ASCN2A | |
| SCHEMBL22117 | 0.84 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2D6SCN1ASCN2A | |
| SCHEMBL17416884 | 0.84 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2D6SCN1ASCN2A | |
| SCHEMBL7820620 | 0.83 | PTPN11 (0.64) | PTPN11S1PR3TP53TSHRPLA2G4B | |
| SCHEMBL5492191 | 0.83 | PTPN11 (0.64) | PTPN11S1PR3TP53TSHRPLA2G4B |
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-101186577-A | Liquid crystal monomer with reaction character and preparation method thereof | NORTHWEST IND UNIVERSITY (CN) | 2008-05-28 | — | — | CN | disclosed |