Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | ROS1 | P08922 | 1/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.37 |
| ▸ | FLT4 | P35916 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 2/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 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 | |
|---|---|---|---|---|
| SCHEMBL27853767 | 0.87 | EGFR (0.44) | EGFRJAK2ROS1PDGFRAFLT4 | |
| SCHEMBL941807 | 0.80 | MMP2 (0.43) | MMP2MMP9MMP8MMP13 | |
| SCHEMBL12264731 | 0.76 | LMNA (0.41) | EGFRJAK2ROS1PDGFRAFLT4 | |
| SCHEMBL27829237 | 0.76 | DRD2 (0.42) | EGFRLMNAMMP2MMP9MMP8 | |
| SCHEMBL12264736 | 0.74 | DGAT1 (0.38) | LMNA | |
| SCHEMBL12427963 | 0.73 | TYMP (0.43) | LMNA | |
| SCHEMBL12427908 | 0.70 | TYMP (0.44) | ALDH1A1LMNA | |
| SCHEMBL28541140 | 0.70 | ALDH1A1 (0.43) | ALDH1A1KDM4ETDP1NCF1LMNA | |
| SCHEMBL21219198 | 0.69 | ALDH1A1 (0.41) | ALDH1A1KDM4ENCF1LMNAMAPT | |
| SCHEMBL12427881 | 0.69 | TYMP (0.43) | LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101921263-A | 2-metridazloe derivative as well as application and preparation method thereof | UNIV LANZHOU | 2010-12-22 | — | — | CN | disclosed |