Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | XPO1 | O14980 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29028859 | 1.00 | ALDH1A1 (0.39) | ALDH1A1GAACASP1LMNAHTR3E | |
| SCHEMBL24241353 | 0.84 | KMO (0.40) | ALDH1A1LMNAKDRXPO1GLA | |
| SCHEMBL30397234 | 0.79 | NOTUM (0.45) | ALDH1A1LMNAKDRXPO1CFTR | |
| SCHEMBL24241153 | 0.79 | NOTUM (0.45) | ALDH1A1LMNAKDRXPO1CFTR | |
| SCHEMBL565746 | 0.77 | CASP1 (0.50) | ALDH1A1CASP1LMNAXPO1SCN9A | |
| SCHEMBL14783265 | 0.75 | CFTR (0.46) | SLC9A1CFTR | |
| SCHEMBL7591353 | 0.74 | KMO (0.40) | LMNAKDRGLAHPGDKMO | |
| SCHEMBL675996 | 0.73 | PIK3CD (0.37) | XPO1KMOPIK3CD | |
| SCHEMBL29687228 | 0.73 | PIK3CD (0.37) | XPO1KMOPIK3CD | |
| SCHEMBL21543008 | 0.73 | LMNA (0.39) | ALDH1A1GAACASP1LMNAKDR |
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-116171154-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-05-26 | — | — | CN | disclosed |