Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21495052 | 1.00 | ALDH1A1 (0.35) | ALDH1A1GLASMN1; SMN2IDO1CYP3A4 | |
| SCHEMBL1515891 | 0.90 | BRD4 (0.34) | ALDH1A1GLASMN1; SMN2IDO1CYP3A4 | |
| SCHEMBL1156420 | 0.87 | IDO1 (0.44) | ALDH1A1IDO1CYP2D6 | |
| SCHEMBL25326059 | 0.87 | IDO1 (0.44) | ALDH1A1IDO1CYP2D6 | |
| SCHEMBL1515769 | 0.83 | IDO1 (0.46) | IDO1CYP3A4CYP2C19 | |
| SCHEMBL29952704 | 0.83 | IDO1 (0.42) | IDO1 | |
| SCHEMBL193457 | 0.81 | IDO1 (0.49) | IDO1 | |
| Hydrochloric Acid SCHEMBL10963051 | 0.77 | SLC6A2 (0.41) | SLC6A3 | |
| SCHEMBL1515884 | 0.72 | SLC6A3 (0.47) | SMN1; SMN2CYP3A4CYP2C19TSHRSLC6A3 | |
| SCHEMBL1515832 | 0.72 | SLC6A3 (0.47) | SMN1; SMN2CYP3A4CYP2C19TSHRSLC6A3 |
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-112313229-A | Substituted aminothiazoles as inhibitors of nucleases | 马萨里克大学 | 2021-02-02 | — | — | CN | disclosed |