Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19105217 | 0.90 | NPC1 (0.38) | ACHENPC1POLBTSHRCYP1A2 | |
| SCHEMBL6972555 | 0.80 | NPC1 (0.37) | ACHENPC1POLBTSHRSLC1A3 | |
| SCHEMBL19116958 | 0.79 | MMP1 (0.33) | — | |
| SCHEMBL19117841 | 0.78 | POLB (0.34) | ACHENPC1POLBTSHR | |
| SCHEMBL2478567 | 0.77 | NPC1 (0.41) | ACHENPC1POLBTSHRSLC1A3 | |
| SCHEMBL27657800 | 0.77 | NPC1 (0.41) | ACHENPC1POLBTSHRSLC1A3 | |
| SCHEMBL21228301 | 0.77 | NPC1 (0.41) | ACHENPC1POLBTSHRSLC1A3 | |
| SCHEMBL29151602 | 0.77 | NPC1 (0.39) | NPC1POLBTSHRSLC1A3SLC1A2 | |
| Trifluoroacetic Acid SCHEMBL4666819 | 0.76 | NOS1 (0.35) | ACHENPC1 | |
| SCHEMBL3903232 | 0.75 | MMP8 (0.43) | POLBTSHRCYP1A2 |
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-20170200976-A1 | NON-AQUEOUS ELECTROLYTIC SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2017-07-13 | — | — | US | disclosed |