Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9583670 | 0.80 | SRC (0.59) | CYP2C19BLMCYP2C9CETPSRC | |
| SCHEMBL4133273 | 0.80 | HPGD (0.46) | CYP2C19SMN1; SMN2BLMHPGDMAPK1 | |
| SCHEMBL17626580 | 0.78 | SRC (0.57) | CYP2C19CYP2C9CETPSRCTDP1 | |
| SCHEMBL17626503 | 0.78 | SRC (0.57) | CYP2C19CYP2C9CETPSRCTDP1 | |
| SCHEMBL17626531 | 0.78 | SRC (0.57) | CYP2C19CYP2C9CETPSRCTDP1 | |
| SCHEMBL28074473 | 0.78 | CYP2C19 (0.58) | CYP2C19SMN1; SMN2BLMHPGDMAPK1 | |
| SCHEMBL17169180 | 0.77 | CES2 (0.53) | CYP2C19SMN1; SMN2BLMHPGDMAPK1 | |
| SCHEMBL6473557 | 0.77 | SRC (0.60) | CYP2C19BLMHPGDCYP1A2CYP2C9 | |
| SCHEMBL4946779 | 0.75 | HPGD (0.49) | CYP2C19SMN1; SMN2BLMHPGDMAPK1 | |
| Fluoride SCHEMBL31047201 | 0.75 | CES2 (0.52) | CYP2C19SMN1; SMN2BLMHPGDMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10333172-B2 | Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery | MITSUBISHI CHEMICAL CORPORATION (JP) | 2019-06-25 | — | — | US | disclosed |
| US-10290901-B2 | — | — | 2019-05-14 | — | — | US | disclosed |
| US-20170084955-A1 | NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEMICAL CORPORATION (JP) | 2017-03-23 | — | — | US | disclosed |