Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | CCR3 | P51677 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | PTGFR | P43088 | 1/20 | 0.34 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.34 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.34 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29749448 | 0.94 | ALDH1A1 (0.44) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| SCHEMBL14959 | 0.94 | ALDH1A1 (0.44) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| Water SCHEMBL28085262 | 0.91 | ALDH1A1 (0.43) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| Benzene SCHEMBL9141668 | 0.91 | ALDH1A1 (0.43) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| SCHEMBL6849255 | 0.91 | ALDH1A1 (0.43) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| SCHEMBL9576114 | 0.91 | ALDH1A1 (0.43) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| SCHEMBL28802097 | 0.91 | ALDH1A1 (0.43) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| SCHEMBL8590907 | 0.89 | ALDH1A1 (0.41) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| Methylamine SCHEMBL1256495 | 0.89 | ALDH1A1 (0.41) | ALDH1A1GABRA1GABRB2CCR3MGLL | |
| Dimethylamine SCHEMBL8062717 | 0.88 | ALDH1A1 (0.40) | ALDH1A1GABRA1GABRB2CCR3MGLL |
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-108140836-A | Carbonaceous material for nonaqueous electrolyte secondary battery, negative electrode for nonaqueous electrolyte secondary battery, and method for producing carbonaceous material for nonaqueous electrolyte secondary battery | 株式会社可乐丽 | 2018-06-08 | — | — | CN | disclosed |
| CN-108140835-A | Carbonaceous material for nonaqueous electrolyte secondary battery, negative electrode for nonaqueous electrolyte secondary battery, and nonaqueous electrolyte secondary battery | 株式会社可乐丽 | 2018-06-08 | — | — | CN | disclosed |