Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR5 | P32302 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | BID | P55957 | 3/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31296495 | 0.83 | MAOA (0.36) | KDM4ECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31296419 | 0.82 | MEN1 (0.37) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL31296414 | 0.76 | CHRM3 (0.39) | KDM4ECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31296421 | 0.76 | CNR2 (0.37) | CXCR5KDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL31296457 | 0.75 | NR1H2 (0.39) | KDM4E | |
| SCHEMBL31296472 | 0.74 | SCN1A (0.37) | KDM4ETSHR | |
| SCHEMBL31296463 | 0.73 | ALDH1A1 (0.38) | KDM4ECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31296485 | 0.73 | HPGD (0.31) | — | |
| SCHEMBL31296486 | 0.71 | — | — | |
| SCHEMBL31296456 | 0.71 | — | — |
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-119219681-A | Method for synthesizing axial chiral organoboron compounds | 合成化学暨分子生物学有限公司 | 2024-12-31 | — | — | CN | disclosed |