Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | ECE1 | P42892 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | CTSA | P10619 | 3/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NOD2 | Q9HC29 | 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 | |
|---|---|---|---|---|
| SCHEMBL15595925 | 0.82 | HPGDS (0.46) | HPGDSKDM4EL3MBTL1GSK3BECE1 | |
| SCHEMBL16600772 | 0.76 | GRIN2B (0.42) | GSK3BPTPN1GRIN1GRIN2B | |
| SCHEMBL31224297 | 0.75 | PLK1 (0.44) | HPGDSKDM4EL3MBTL1CTSACNR2 | |
| SCHEMBL16533569 | 0.75 | CTSA (0.46) | CTSA | |
| SCHEMBL15595705 | 0.74 | CTSA (0.56) | CTSACNR2 | |
| SCHEMBL2227844 | 0.71 | GSK3B (0.40) | KDM4EL3MBTL1GSK3BPTPN1ALDH1A1 | |
| SCHEMBL24667804 | 0.70 | CCR1 (0.42) | KDM4EL3MBTL1LMNAMAPK1HTT | |
| SCHEMBL3433496 | 0.70 | GSK3B (0.43) | HPGDSKDM4EGSK3BPTPN1CTSA | |
| SCHEMBL31678819 | 0.70 | GSK3B (0.43) | HPGDSKDM4EGSK3BPTPN1CTSA | |
| SCHEMBL26019074 | 0.70 | KDM4E (0.38) | KDM4EL3MBTL1LMNAHTTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3683207-A1 | N-ALKYLARYL-5-OXYARYL-OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE ALLOSTERIC MODULATORS OF NR2B | Cadent Therapeutics, Inc. (US) | 2020-07-22 | — | — | EP | disclosed |