Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8669756 | 0.87 | HRH3 (0.43) | KDM1AKDM4EATMHTTOPRD1 | |
| SCHEMBL31236087 | 0.81 | HTR2C (0.49) | KDM1AOPRD1HTR2CDRD2HTR2A | |
| SCHEMBL537937 | 0.81 | HTR2C (0.52) | KDM1AOPRD1KCNH2HTR2CDRD2 | |
| SCHEMBL28524517 | 0.80 | HTR2C (0.52) | OPRD1KCNH2OPRM1ADRA2AHTR2C | |
| Hydrochloric Acid SCHEMBL1691145 | 0.79 | HTR2C (0.51) | KDM1AOPRD1KCNH2HTR2CDRD2 | |
| SCHEMBL18159334 | 0.78 | MAPT (0.41) | KDM1AKDM4EOPRD1KCNH2OPRM1 | |
| SCHEMBL4214545 | 0.77 | KDM4E (0.47) | KDM4EATMHTTOPRD1KCNH2 | |
| SCHEMBL471621 | 0.76 | SIGMAR1 (0.53) | OPRD1KCNH2OPRM1HTR2CDRD2 | |
| SCHEMBL30538343 | 0.76 | SIGMAR1 (0.53) | OPRD1KCNH2OPRM1HTR2CDRD2 | |
| SCHEMBL7606467 | 0.76 | PKM (0.40) | KDM1AKDM4EADRA2AALDH1A1MAPT |
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-2018026371-A1 | DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS | SUNOVION PHARMACEUTICALS INC. (US) | 2018-02-08 | — | — | WO | disclosed |