Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 6/20 | 0.59 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HK1 | P19367 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.49 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | PDE5A | O76074 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1605597 | 0.89 | PTGES2 (0.49) | CYP11B2PTGDR2MAPTTBXAS1HSD17B10 | |
| SCHEMBL1606366 | 0.86 | CYP11B2 (0.63) | CYP11B2HTTTBXAS1ALDH1A1HSD17B10 | |
| SCHEMBL1605126 | 0.84 | TP53 (0.47) | CYP11B2PTGDR2MAPTTBXAS1PTGES2 | |
| SCHEMBL7948226 | 0.81 | CYP11B2 (0.51) | CYP11B2TBXAS1PTGES2CYP11B1KDM4E | |
| SCHEMBL1605952 | 0.80 | CYP11B2 (0.50) | CYP11B2PTGDR2TBXAS1PTGES2CYP11B1 | |
| SCHEMBL1604919 | 0.80 | CYP11B2 (0.49) | CYP11B2TBXAS1ALDH1A1CYP11B1SMN1; SMN2 | |
| SCHEMBL7803232 | 0.79 | TBXAS1 (0.58) | CYP11B2PTGDR2MAPTTBXAS1ALDH1A1 | |
| SCHEMBL1604835 | 0.78 | GRIN1 (0.48) | CYP11B2ALDH1A1CYP11B1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL30385478 | 0.77 | GRIN1 (0.47) | CYP11B2ALDH1A1CYP11B1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1606192 | 0.77 | GRIN1 (0.47) | CYP11B2ALDH1A1CYP11B1SMN1; SMN2 |
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-104193725-B | Organic compound | 诺华股份有限公司 | 2016-11-16 | — | — | CN | disclosed |