Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | SCN1A | P35498 | 3/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.37 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL767297 | 0.82 | IDO1 (0.39) | HTTLMNASCN1ASCN2ASCN3A | |
| Butane SCHEMBL4824910 | 0.74 | POLB (0.42) | POLBHTTSMN1; SMN2MEN1KMT2A | |
| Toluene SCHEMBL11343606 | 0.72 | TSHR (0.48) | MEN1KMT2ALMNATSHRALDH1A1 | |
| Benzene SCHEMBL649962 | 0.72 | — | — | |
| SCHEMBL7183743 | 0.71 | PPARA (0.38) | POLBSMN1; SMN2MEN1KMT2ALMNA | |
| Phenol SCHEMBL11346379 | 0.71 | CA12 (0.46) | MEN1KMT2ALMNACYP1A2TSHR | |
| Phenol SCHEMBL27580064 | 0.71 | CA12 (0.46) | MEN1KMT2ALMNACYP1A2TSHR | |
| SCHEMBL8010055 | 0.71 | LTA4H (0.41) | SMN1; SMN2TSHRHPGD | |
| SCHEMBL7192281 | 0.70 | LMNA (0.39) | POLBMEN1KMT2ALMNACYP2D6 | |
| SCHEMBL28354551 | 0.70 | MEN1 (0.36) | HTTMEN1KMT2AKCNH2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105580189-B | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | 三菱化学株式会社 | 2017-09-22 | — | — | CN | disclosed |
| CN-105580189-A | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | MITSUBISHI CHEM CORP | 2016-05-11 | — | — | CN | disclosed |