Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | TSPO | P30536 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 5/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | RAC2 | P15153 | 1/20 | 0.34 |
| ▸ | RAC3 | P60763 | 1/20 | 0.34 |
| ▸ | CDC42 | P60953 | 1/20 | 0.34 |
| ▸ | RAC1 | P63000 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL25919666 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL21481357 | 0.95 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL21481362 | 0.95 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL25944615 | 0.95 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL25847040 | 0.94 | KDM4E (0.47) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL25920534 | 0.94 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL21407088 | 0.93 | KDM4E (0.46) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL21481285 | 0.92 | ALDH1A1 (0.45) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL25919664 | 0.92 | ALDH1A1 (0.37) | ALDH1A1TSHRCYP2C19KDM4EATM | |
| SCHEMBL25919663 | 0.92 | ALDH1A1 (0.37) | ALDH1A1TSHRCYP2C19KDM4EATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023142485-A1 | BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 季华恒烨(佛山)电子材料有限公司 | 2023-08-03 | — | — | WO | disclosed |