Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.37 |
| ▸ | CACNA1H | O95180 | 5/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | GRN | P28799 | 3/20 | 0.36 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.36 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.36 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28664287 | 0.91 | CACNA1H (0.39) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28658947 | 0.91 | KCNH2 (0.37) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28655462 | 0.90 | GRN (0.38) | ALDH1A1SMN1; SMN2KCNH2CACNA1HCYP2D6 | |
| SCHEMBL28658945 | 0.89 | KCNH2 (0.36) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28670645 | 0.89 | MEN1 (0.37) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28668464 | 0.89 | KCNH2 (0.36) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28656291 | 0.87 | KCNH2 (0.35) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL30271514 | 0.85 | KCNH2 (0.34) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28655487 | 0.85 | SMYD3 (0.37) | KCNH2CACNA1HCYP2D6GRNSORT1 | |
| SCHEMBL28651103 | 0.85 | HDAC3 (0.47) | KCNH2GRNSORT1MEN1KMT2A |
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 |