Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28299972 | 0.84 | ALDH1A1 (0.49) | ALDH1A1TSHRTHRB | |
| SCHEMBL246033 | 0.81 | ALDH1A1 (0.65) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL26861224 | 0.78 | ALDH1A1 (0.61) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL28353974 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19 | |
| Formic Acid SCHEMBL28907439 | 0.77 | ALDH1A1 (0.86) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL19116313 | 0.76 | ALDH1A1 (0.58) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL5098181 | 0.75 | ALDH1A1 (1.00) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL2048901 | 0.75 | ALDH1A1 (1.00) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL5098171 | 0.75 | ALDH1A1 (1.00) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 | |
| SCHEMBL15617 | 0.75 | ALDH1A1 (1.00) | ALDH1A1TSHRTHRBCYP3A4CYP2D6 |
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-109912790-A | A kind of modified polycarbonate with highly blood coagulation resistant | 西南交通大学 | 2019-06-21 | — | — | CN | claimed |