Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2467441 | 0.91 | KDM4E (0.56) | ALDH1A1KDM4EGAAMEN1KMT2A | |
| SCHEMBL2470923 | 0.85 | CYP2D6 (0.54) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL19779408 | 0.81 | KMT2A (0.53) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL1961694 | 0.80 | KMT2A (0.52) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL15367649 | 0.79 | KMT2A (0.53) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL14517088 | 0.79 | CYP2D6 (0.50) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL4299006 | 0.79 | NPFFR1 (0.51) | CYP2D6ALDH1A1KMT2AL3MBTL1CYP3A4 | |
| SCHEMBL2468808 | 0.78 | CYP2D6 (0.49) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL2470540 | 0.78 | CYP2D6 (0.47) | CYP2D6ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL18203100 | 0.76 | L3MBTL1 (0.63) | CYP2D6ALDH1A1GAAMEN1KMT2A |
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-105732636-B | Heteroaromatic compounds and their use in medicine | 广东东阳光药业有限公司 | 2020-04-21 | — | — | CN | disclosed |