Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21119447 | 0.92 | CYP3A4 (0.47) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL21120017 | 0.90 | HPGD (0.38) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL23349673 | 0.88 | CYP3A4 (0.43) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL21117200 | 0.79 | SRC (0.45) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL21117271 | 0.79 | SRC (0.45) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL21119474 | 0.77 | CYP3A4 (0.42) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL21119472 | 0.76 | CYP3A4 (0.48) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| Triphenyl Phosphate SCHEMBL28101456 | 0.74 | CYP3A4 (0.62) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| SCHEMBL5381000 | 0.74 | SRC (0.56) | CYP3A4TSHRMAPK1TDP1ALDH1A1 | |
| Triphenyl Phosphate SCHEMBL2530073 | 0.74 | SRC (0.61) | CYP3A4TSHRTDP1L3MBTL1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3506411-A1 | ORGANIC ELECTROLYTE SOLUTION AND LITHIUM BATTERY INCLUDING THE SAME | Samsung Electronics Co., Ltd. (KR) | 2019-07-03 | — | — | EP | disclosed |