Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 5/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16865155 | 0.89 | CYP17A1 (0.46) | CYP17A1CYP19A1CYP3A4MAPTKMT2A | |
| SCHEMBL16865212 | 0.88 | CYP17A1 (0.37) | CYP17A1CYP19A1CYP3A4MAPTTAS1R3 | |
| SCHEMBL16865184 | 0.79 | MEN1 (0.36) | CYP17A1CYP19A1MAPTTAS1R3TAS1R1 | |
| SCHEMBL32674103 | 0.76 | ALDH1A1 (0.53) | CYP17A1CYP19A1KMT2ATSHRCYP2C19 | |
| SCHEMBL16865152 | 0.73 | ADAM17 (0.35) | CYP17A1CYP19A1CYP3A4MAPTMEN1 | |
| SCHEMBL16865202 | 0.72 | ALDH1A1 (0.49) | CYP17A1CYP19A1KMT2ATSHRCYP2C19 | |
| SCHEMBL16865166 | 0.71 | NPC1 (0.38) | MAPTMEN1KMT2ATSHRSLC6A2 | |
| SCHEMBL12231040 | 0.71 | ALDH1A1 (0.43) | MAPTTAS1R3TAS1R1MIFMEN1 | |
| SCHEMBL1051823 | 0.71 | ALDH1A1 (0.58) | CYP3A4MAPTTAS1R3TAS1R1MIF | |
| SCHEMBL25317306 | 0.71 | ALDH1A1 (0.50) | CYP17A1CYP19A1KMT2ATSHRSLC6A2 |
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 |