Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.42 |
| ▸ | TOP2A | P11388 | 6/20 | 0.42 |
| ▸ | TOP2B | Q02880 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9749358 | 0.89 | KCNH2 (0.45) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL9749871 | 0.88 | TOP2A (0.55) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL10425104 | 0.88 | TOP2A (0.55) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL9749842 | 0.88 | KCNH2 (0.42) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL9749868 | 0.86 | NTRK1 (0.35) | KCNH2ALDH1A1KDM4EHPGDPOLB | |
| SCHEMBL9749299 | 0.85 | KDM4E (0.40) | ALDH1A1KDM4EHPGDPOLBHSD17B10 | |
| SCHEMBL10811238 | 0.83 | KCNH2 (0.47) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL9668073 | 0.83 | KCNH2 (0.47) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL9671101 | 0.83 | KCNH2 (0.45) | KCNH2TOP2ATOP2BALDH1A1KDM4E | |
| SCHEMBL9376759 | 0.81 | KCNH2 (0.44) | KCNH2TOP2ATOP2BALDH1A1KDM4E |
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-0216345-B1 | QUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1992-02-19 | — | — | EP | disclosed |
| EP-0216345-A2 | Quinoline derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1987-04-01 | — | — | EP | disclosed |