Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MCOLN2 | Q8IZK6 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4408287 | 0.94 | ALDH1A1 (0.51) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 | |
| SCHEMBL4405441 | 0.78 | CNR2 (0.52) | ALDH1A1CYP2C19CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4409109 | 0.78 | ALDH1A1 (0.49) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 | |
| SCHEMBL7089605 | 0.75 | ALDH1A1 (0.50) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 | |
| SCHEMBL4413524 | 0.75 | ALDH1A1 (0.50) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 | |
| SCHEMBL11175358 | 0.75 | ALDH1A1 (0.50) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 | |
| SCHEMBL4405841 | 0.74 | ALDH1A1 (0.46) | ALDH1A1CYP2C19CYP1A2POLBTDP1 | |
| SCHEMBL4408572 | 0.73 | ALDH1A1 (0.45) | ALDH1A1CYP2C19CYP1A2POLBTDP1 | |
| SCHEMBL1779637 | 0.72 | ALDH1A1 (0.47) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 | |
| SCHEMBL10671615 | 0.72 | ALDH1A1 (0.41) | ALDH1A1CYP2C19CYP1A2POLBCYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100402508-C | Alkoxytetrazol-1-ylbenzaldehyde compound and process for producing the same | TOYO KASEI KOGYO CO LTD (JP) | 2008-07-16 | — | — | CN | disclosed |
| CN-1826329-A | Alkoxy- (tetrazol-1-yl) benzaldehyde compound and process for producing the same | TOYO KASEI KOGYO CO LTD (JP) | 2006-08-30 | — | — | CN | disclosed |