Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDR1 | Q08345 | 8/20 | 0.34 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | FLT1 | P17948 | 1/20 | 0.31 |
| ▸ | FLT4 | P35916 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | CCR9 | P51686 | 1/20 | 0.30 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28670333 | 0.79 | MMP2 (0.42) | CACNA1HKCNH2CYP2D6ALDH1A1PTGS2 | |
| SCHEMBL28651103 | 0.79 | HDAC3 (0.47) | KCNH2 | |
| SCHEMBL28676235 | 0.78 | ALDH1A1 (0.38) | CACNA1HKCNH2CYP2D6ALDH1A1CACNA1I | |
| SCHEMBL28664287 | 0.78 | CACNA1H (0.39) | CACNA1HKCNH2CYP2D6CACNA1I | |
| SCHEMBL28658947 | 0.78 | KCNH2 (0.37) | CACNA1HKCNH2CYP2D6CACNA1I | |
| SCHEMBL28656141 | 0.78 | ALDH1A1 (0.39) | KCNH2CYP2D6ALDH1A1 | |
| SCHEMBL28658945 | 0.77 | KCNH2 (0.36) | CACNA1HKCNH2CYP2D6CACNA1I | |
| SCHEMBL28668464 | 0.77 | KCNH2 (0.36) | CACNA1HKCNH2CYP2D6CACNA1I | |
| SCHEMBL28670645 | 0.77 | MEN1 (0.37) | CACNA1HKCNH2CYP2D6CACNA1I | |
| SCHEMBL28655462 | 0.76 | GRN (0.38) | DDR1CACNA1HKCNH2CYP2D6ALDH1A1 |
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-113692276-A | NURR1 receptor modulators | 加利福尼亚大学董事会 | 2021-11-23 | — | — | CN | disclosed |