Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 7/20 | 0.44 |
| ▸ | TOP2B | Q02880 | 7/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CLK2 | P49760 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12835804 | 0.88 | ADRB2 (0.44) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL3397838 | 0.82 | TOP2A (0.55) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL12836323 | 0.82 | TOP2A (0.42) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL12835806 | 0.79 | TOP2A (0.49) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL7841318 | 0.74 | TOP2A (0.55) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL117416 | 0.72 | ADRB2 (0.47) | TOP2ATOP2BKCNH2HPGDPOLB | |
| SCHEMBL10412626 | 0.71 | TOP2A (0.47) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL115392 | 0.71 | ADRB2 (0.55) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL7851034 | 0.71 | ALDH1A1 (0.50) | TOP2ATOP2BKCNH2ALDH1A1KDM4E | |
| SCHEMBL12836210 | 0.71 | ADRB2 (0.42) | TOP2ATOP2BKCNH2HPGDGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011031745-A1 | ANTIBACTERIAL FLUOROQUINOLONE ANALOGS | ACHAOGEN, INC. (US) | 2011-03-17 | — | — | WO | disclosed |