Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.39 |
| ▸ | TOP2A | P11388 | 4/20 | 0.37 |
| ▸ | TOP2B | Q02880 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | CLK2 | P49760 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12836611 | 0.88 | TOP2A (0.44) | KCNH2TOP2ATOP2BHPGDMEN1 | |
| SCHEMBL117416 | 0.85 | ADRB2 (0.47) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL115392 | 0.85 | ADRB2 (0.55) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL12836210 | 0.84 | ADRB2 (0.42) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL4302223 | 0.83 | ADRB2 (0.51) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL7126309 | 0.83 | ADRB2 (0.57) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL12836412 | 0.82 | ADRB2 (0.49) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL12836620 | 0.82 | ADRB2 (0.50) | ADRB2KCNH2TOP2ATOP2BKMT2A | |
| SCHEMBL12836413 | 0.81 | ADRB2 (0.48) | ADRB2KCNH2TOP2ATOP2BHPGD | |
| SCHEMBL4302235 | 0.81 | ADRB2 (0.49) | ADRB2KCNH2TOP2ATOP2BHPGD |
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 |