Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 8/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.36 |
| ▸ | ALB | P02768 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL1509292 | 1.00 | KCNH2 (0.38) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL1509339 | 1.00 | KCNH2 (0.38) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL1509307 | 0.98 | KCNH2 (0.36) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL1509299 | 0.93 | HTT (0.37) | ALDH1A1DRD2OPRM1DRD3 | |
| SCHEMBL10600111 | 0.78 | DDB1 (0.36) | KCNH2ALDH1A1DRD2SLC6A2HTR2A | |
| SCHEMBL9798892 | 0.78 | KCNH2 (0.47) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL28794932 | 0.77 | PNMT (0.42) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27854621 | 0.77 | PNMT (0.42) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27836596 | 0.77 | PNMT (0.42) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL2920705 | 0.77 | KCNH2 (0.40) | KCNH2ALDH1A1DRD2OPRM1DRD3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8361653-B2 | Non-aqueous electrolyte secondary battery | SHARP KABUSHIKI KAISHA (JP) | 2013-01-29 | — | — | US | disclosed |
| US-20110052982-A1 | NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY | SHARP KABUSHIKI KAISHA (JP) | 2011-03-03 | — | — | US | disclosed |