Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28621921 | 1.00 | PRCP (0.37) | PRCPACHEAHRCHRNA7ESR1 | |
| SCHEMBL30101863 | 0.88 | ESR1 (0.43) | PRCPCHRNA7ESR1ESR2GAA | |
| SCHEMBL6671821 | 0.88 | ESR1 (0.43) | PRCPCHRNA7ESR1ESR2GAA | |
| SCHEMBL30101826 | 0.86 | ESR1 (0.44) | PRCPESR1ESR2KDM4EGAA | |
| SCHEMBL28622036 | 0.86 | MEN1 (0.42) | PRCPAHRCHRNA7ESR1ESR2 | |
| SCHEMBL28625714 | 0.86 | ESR1 (0.44) | PRCPESR1ESR2KDM4EGAA | |
| SCHEMBL28621530 | 0.86 | OPRM1 (0.41) | PRCPCHRNA7ESR1ESR2LMNA | |
| SCHEMBL30101816 | 0.86 | MEN1 (0.42) | PRCPAHRCHRNA7ESR1ESR2 | |
| SCHEMBL30101955 | 0.86 | OPRM1 (0.41) | PRCPCHRNA7ESR1ESR2LMNA | |
| SCHEMBL28630559 | 0.83 | TRPM8 (0.43) | KMT2AKDM4ESMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113264881-B | Synthetic method of alpha-cyanide | 南昌大学 | 2022-12-02 | — | — | CN | disclosed |