Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CASP6 | P55212 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CXCR1 | P25024 | 4/20 | 0.31 |
| ▸ | CXCR2 | P25025 | 4/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9901698 | 0.93 | KDM4E (0.34) | KDM4EGAAKMT2AHCRTR2HCRTR1 | |
| SCHEMBL18727712 | 0.93 | KDM4E (0.34) | KDM4EGAAKMT2AHCRTR2HCRTR1 | |
| SCHEMBL17271393 | 0.87 | HCRTR2 (0.32) | HCRTR2HCRTR1ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL17271392 | 0.87 | HCRTR2 (0.32) | HCRTR2HCRTR1ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL9901299 | 0.86 | GAA (0.41) | KDM4EGAAKMT2AHCRTR2HCRTR1 | |
| SCHEMBL9902441 | 0.86 | P2RX7 (0.43) | KDM4EGAAKMT2AALDH1A1SIGMAR1 | |
| SCHEMBL16994507 | 0.86 | P2RX7 (0.43) | KDM4EGAAKMT2AALDH1A1SIGMAR1 | |
| SCHEMBL9901538 | 0.85 | KDM4E (0.43) | KDM4EGAAKMT2AP2RX7 | |
| SCHEMBL9901542 | 0.85 | KDM4E (0.43) | KDM4EGAAKMT2AP2RX7 | |
| SCHEMBL16994523 | 0.83 | P2RX7 (0.43) | KDM4EGAAKMT2AALDH1A1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2649048-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | Radikal Therapeutics Inc. (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012077108-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | RADIKAL THERAPEUTICS INC. (US) | 2012-06-14 | — | — | WO | disclosed |