Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL16994500 | 1.00 | P2RX7 (0.39) | P2RX7KDM4EGAACYP3A4ALOX15 | |
| SCHEMBL9905806 | 1.00 | P2RX7 (0.39) | P2RX7KDM4EGAACYP3A4ALOX15 | |
| SCHEMBL16994512 | 0.88 | P2RX7 (0.39) | P2RX7KDM4EGAAABCC9KCNJ11 | |
| SCHEMBL17271378 | 0.88 | P2RX7 (0.39) | P2RX7KDM4EGAAABCC9KCNJ11 | |
| SCHEMBL19668355 | 0.87 | P2RX7 (0.43) | P2RX7KDM4ECYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL16994485 | 0.87 | P2RX7 (0.43) | P2RX7KDM4ECYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL9901674 | 0.86 | FPR2 (0.34) | KDM4E | |
| SCHEMBL16994496 | 0.86 | P2RX7 (0.39) | P2RX7GAACYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL16994518 | 0.86 | KDM4E (0.51) | P2RX7KDM4EGAACYP3A4ALOX15 | |
| SCHEMBL9902171 | 0.85 | AR (0.32) | — |
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 |