Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.64 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.50 |
| ▸ | WNT3A | P56704 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL139194 | 1.00 | CES2 (0.64) | CES2SRD5A2CTNNB1WNT3APOLB | |
| SCHEMBL9168508 | 0.89 | CYP1A2 (0.51) | CES2MAOB | |
| SCHEMBL8386448 | 0.84 | CES2 (0.56) | CES2SRD5A2CTNNB1WNT3APOLB | |
| SCHEMBL23263974 | 0.84 | DHODH (0.50) | CES2MAOB | |
| SCHEMBL4306951 | 0.83 | CES2 (0.59) | CES2LMNAP2RX1 | |
| SCHEMBL397191 | 0.82 | GSK3B (0.50) | CES2ACHEHPGDKMT2AMEN1 | |
| SCHEMBL5310454 | 0.82 | ALDH1A1 (0.46) | CES2POLBALDH1A1MAOB | |
| SCHEMBL30758861 | 0.81 | CES2 (0.69) | CES2SRD5A2CTNNB1WNT3APOLB | |
| SCHEMBL1199185 | 0.80 | CES2 (0.54) | CES2SRD5A2CTNNB1WNT3APOLB | |
| SCHEMBL1712437 | 0.80 | CES2 (0.67) | CES2SRD5A2CTNNB1WNT3APOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-118398813-A | Positive electrode slurry, positive electrode sheet and secondary battery | 广东邦普循环科技有限公司 | 2024-07-26 | — | — | CN | claimed |
| CN-118812500-A | Substituted aryl diketone nitrile compound with herbicidal activity, preparation method and application | 东北农业大学 | 2024-10-22 | — | — | CN | disclosed |
| CN-118398813-A | Positive electrode slurry, positive electrode sheet and secondary battery | 广东邦普循环科技有限公司 | 2024-07-26 | — | — | CN | disclosed |