Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16865156 | 0.89 | CYP17A1 (0.39) | CYP17A1CYP19A1MAPTCYP3A4ADAM17 | |
| SCHEMBL32674103 | 0.85 | ALDH1A1 (0.53) | CYP17A1CYP19A1TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL16865202 | 0.81 | ALDH1A1 (0.49) | CYP17A1CYP19A1TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL16865152 | 0.79 | ADAM17 (0.35) | CYP17A1CYP19A1MAPTCYP3A4ADAM17 | |
| SCHEMBL25317306 | 0.79 | ALDH1A1 (0.50) | CYP17A1CYP19A1TSHRALDH1A1MAPK1 | |
| SCHEMBL32674206 | 0.79 | ALDH1A1 (0.50) | CYP17A1CYP19A1TSHRALDH1A1MAPK1 | |
| SCHEMBL16865201 | 0.79 | MAPT (0.35) | MAPTTSHRALDH1A1KMT2ANPSR1 | |
| SCHEMBL9017773 | 0.78 | NPSR1 (0.37) | MAPTTSHRALDH1A1KMT2ANPSR1 | |
| SCHEMBL16865212 | 0.76 | CYP17A1 (0.37) | CYP17A1CYP19A1MAPTCYP3A4ADAM17 | |
| SCHEMBL16865196 | 0.75 | ALDH1A1 (0.43) | CYP17A1CYP19A1CYP3A4TSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20150188193-A1 | NON-AQUEOUS LIQUID ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY | FUJIFILM CORPORATION (JP) | 2015-07-02 | — | — | US | disclosed |