Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | SCN1A | P35498 | 2/20 | 0.56 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.56 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.47 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3701345 | 0.88 | NSD2 (0.72) | NSD2CYP3A4SCN1ASCN2ASCN3A | |
| SCHEMBL10453019 | 0.83 | NSD2 (0.58) | NSD2CYP3A4SCN1ASCN2ASCN3A | |
| SCHEMBL3680789 | 0.82 | CYP3A4 (0.64) | CYP3A4SCN1ASCN2ASCN3AKDM4E | |
| SCHEMBL14919628 | 0.81 | NSD2 (0.83) | NSD2CYP3A4KDM4EALDH1A1CYP1A2 | |
| SCHEMBL3698543 | 0.80 | CYP3A4 (0.69) | CYP3A4SCN1ASCN2ASCN3AKDM4E | |
| SCHEMBL2878189 | 0.79 | SCN1A (0.59) | CYP3A4SCN1ASCN2ASCN3AKDM4E | |
| SCHEMBL11361752 | 0.79 | NPY5R (0.51) | NSD2ALDH1A1SMN1; SMN2NPY5R | |
| SCHEMBL27488281 | 0.78 | CYP1A2 (0.72) | CYP3A4SCN1ASCN2ASCN3AKDM4E | |
| SCHEMBL11107112 | 0.78 | HDAC1 (0.53) | NSD2CYP3A4SCN1ASCN2ASCN3A | |
| SCHEMBL11107108 | 0.78 | HDAC1 (0.53) | NSD2CYP3A4SCN1ASCN2ASCN3A |
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-2011111880-A1 | PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING DISEASES CAUSED BY THE NUCLEAR EXPORT OF GSK3, INCLUDING A COMPOUND FOR INHIBITING THE NUCLEAR EXPORT OF GSK3 | 주식회사 메디젠텍 (KR) | 2011-09-15 | — | — | WO | disclosed |