Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.38 |
| ▸ | HTR3B | O95264 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | NOS2 | P35228 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL9902957 | 0.86 | KDM4E (0.37) | KDM4EGAAKMT2ASIGMAR1ALOX15 | |
| SCHEMBL9901797 | 0.80 | HTR3E (0.41) | KDM4EGAAKMT2AHTR3EHTR3B | |
| SCHEMBL9902558 | 0.79 | KDM4E (0.37) | KDM4EGAAKMT2A | |
| SCHEMBL9903038 | 0.77 | NOS1 (0.38) | KDM4EGAAKMT2ASIGMAR1NOS3 | |
| SCHEMBL9902255 | 0.76 | KDM4E (0.50) | KDM4EGAAKMT2AALDH1A1ALOX15 | |
| SCHEMBL9902286 | 0.75 | KDM4E (0.35) | KDM4EGAAKMT2A | |
| SCHEMBL9902516 | 0.74 | GAA (0.40) | KDM4EGAAKMT2AALDH1A1POLB | |
| SCHEMBL9901736 | 0.73 | KDM4E (0.35) | KDM4EGAAKMT2A | |
| SCHEMBL9905737 | 0.71 | KDM4E (0.47) | KDM4EGAAKMT2AALDH1A1ALOX15 | |
| SCHEMBL17271397 | 0.71 | GAA (0.36) | KDM4EGAAKMT2AALDH1A1POLB |
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 |