Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | F2R | P25116 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL29262271 | 0.93 | ABL1 (0.53) | ALDH1A1ABL1TLR8HTTTDP1 | |
| SCHEMBL15928722 | 0.89 | ALDH1A1 (0.43) | ALDH1A1ABL1HTTTDP1CASP1 | |
| SCHEMBL2455817 | 0.86 | ALDH1A1 (0.49) | ALDH1A1HTTTDP1CASP1CYP3A4 | |
| SCHEMBL10394666 | 0.83 | ALDH1A1 (0.68) | ALDH1A1ABL1HTTTDP1AR | |
| SCHEMBL6228833 | 0.81 | ALDH1A1 (0.71) | ALDH1A1ABL1HTTTDP1CASP1 | |
| SCHEMBL6227906 | 0.81 | ALDH1A1 (0.71) | ALDH1A1ABL1HTTTDP1CASP1 | |
| SCHEMBL5012623 | 0.81 | ALDH1A1 (0.46) | ALDH1A1HTTTDP1CASP1CYP3A4 | |
| SCHEMBL11798071 | 0.80 | ALDH1A1 (0.54) | ALDH1A1ABL1TLR8HTTBACE1 | |
| SCHEMBL11443275 | 0.80 | ALDH1A1 (0.54) | ALDH1A1HTTTDP1CASP1CYP3A4 | |
| SCHEMBL26325050 | 0.80 | ALDH1A1 (0.50) | ALDH1A1ABL1HTTBACE1AR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000073368-A1 | COMPOSITION FOR USE IN FLEXIBLE POLYURETHANE FOAMS | SOLUTIA INC. (US) | 2000-12-07 | — | — | WO | disclosed |