Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 5/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | KDM5A | P29375 | 3/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 3/20 | 0.41 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP2C18 | P33260 | 2/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18256245 | 0.87 | KDM5A (0.49) | NPBWR1MCHR1ALDH1A1KMT2ARAB9A | |
| SCHEMBL5805236 | 0.85 | KDM5A (0.40) | NPBWR1MCHR1ALDH1A1KMT2ARAB9A | |
| SCHEMBL13495221 | 0.84 | POLB (0.47) | ALDH1A1KDM5AKDM4CKDM5BMAPT | |
| SCHEMBL5805183 | 0.74 | MAPT (0.39) | ALDH1A1KMT2ARAB9AKDM5AKDM4C | |
| SCHEMBL28575271 | 0.73 | NR3C2 (0.46) | NPBWR1MCHR1ALDH1A1KMT2ARAB9A | |
| SCHEMBL20001743 | 0.72 | LMNA (0.39) | ALDH1A1KMT2ARAB9AMAPTL3MBTL1 | |
| SCHEMBL9831007 | 0.72 | ALDH1A1 (0.46) | NPBWR1MCHR1ALDH1A1KMT2ARAB9A | |
| SCHEMBL23130273 | 0.71 | CYP2C9 (0.49) | ALDH1A1KMT2ARAB9AKDM5AKDM4C | |
| SCHEMBL20001748 | 0.71 | KDM5A (0.53) | ALDH1A1KMT2AKDM5AKDM4CKDM5B | |
| SCHEMBL13382586 | 0.70 | — | — |
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-2016184378-A1 | SUBSTITUTED PYRAZOLE COMPOUNDS CONTAINING PYRIMIDINE AND PREPARATION METHOD AND USE THEREOF | 沈阳中化农药化工研发有限公司 | 2016-11-24 | — | — | WO | disclosed |