Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.49 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.49 |
| ▸ | CFTR | P13569 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.48 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27492286 | 0.94 | CYP19A1 (0.52) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| SCHEMBL575045 | 0.85 | AKR1C3 (0.57) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| SCHEMBL6259017 | 0.85 | AKR1C3 (0.57) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| Potassium Ion SCHEMBL28321383 | 0.85 | CYP19A1 (0.46) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| Hydrochloric Acid SCHEMBL4076278 | 0.84 | AKR1C3 (0.56) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| SCHEMBL27446830 | 0.84 | AKR1C3 (0.56) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| Pyridine SCHEMBL28232654 | 0.83 | POLB (0.47) | SMN1; SMN2CYP19A1CYP17A1SLC6A2SLC6A4 | |
| SCHEMBL22899009 | 0.81 | CYP19A1 (0.51) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| SCHEMBL17233924 | 0.80 | CYP17A1 (0.50) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 | |
| SCHEMBL4418464 | 0.80 | CYP19A1 (0.54) | SMN1; SMN2CYP19A1CYP17A1CFTRSLC6A2 |
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-108290881-A | Therapeutic compounds and methods of use thereof | 健泰科生物技术公司 | 2018-07-17 | — | — | CN | disclosed |