Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | CLPP | Q16740 | 1/20 | 0.42 |
| ▸ | DHPS | P49366 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30337246 | 0.91 | ENPP2 (0.47) | KMT2ACCR5GRM2SMN1; SMN2ENPP2 | |
| SCHEMBL24145803 | 0.90 | ENPP2 (0.48) | ALDH1A1CCR5GRM2ENPP2 | |
| SCHEMBL28980919 | 0.87 | KMT2A (0.46) | ALDH1A1KDM4EMEN1KMT2ACLPP | |
| SCHEMBL30337129 | 0.87 | KMT2A (0.46) | ALDH1A1KDM4EMEN1KMT2ACLPP | |
| SCHEMBL30337582 | 0.85 | SMN1; SMN2 (0.45) | POLBKMT2ASMN1; SMN2CHRM2CHRM3 | |
| SCHEMBL30337392 | 0.83 | ALDH1A1 (0.44) | ALDH1A1KDM4EPOLBMAPTCCR5 | |
| SCHEMBL30337066 | 0.82 | FAAH (0.48) | — | |
| SCHEMBL30337060 | 0.82 | KMT2A (0.49) | MEN1KMT2ACLPPENPP2 | |
| SCHEMBL30337208 | 0.80 | ENPP2 (0.43) | ALDH1A1MAPTCCR5GRM2ENPP2 | |
| SCHEMBL24145684 | 0.79 | FAAH (0.39) | ALDH1A1CCR5ENPP2 |
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-115916206-A | Novel compound and pharmaceutical composition for preventing or treating resistant cancer comprising same | 治愈医药社株式会社 | 2023-04-04 | — | — | CN | disclosed |