Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
| ▸ | TOP2A | P11388 | 2/20 | 0.36 |
| ▸ | TOP2B | Q02880 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL28401918 | 0.89 | ALDH1A1 (0.35) | KCNH2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28404470 | 0.86 | ADRB2 (0.39) | TOP2ATOP2BMEN1KMT2A | |
| SCHEMBL28408025 | 0.85 | KCNH2 (0.36) | KCNH2POLBTOP2ATOP2B | |
| SCHEMBL8540093 | 0.85 | KCNH2 (0.41) | KCNH2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28401669 | 0.82 | ESR1 (0.39) | ALDH1A1POLBGSK3BKMT2A | |
| SCHEMBL3337171 | 0.81 | KCNH2 (0.41) | KCNH2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4305779 | 0.81 | TOP2A (0.42) | KCNH2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9428229 | 0.78 | TOP2A (0.40) | KCNH2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4518378 | 0.76 | TNF (0.35) | TOP2ATOP2B | |
| SCHEMBL536999 | 0.74 | ADRB2 (0.40) | KCNH2POLBGSK3B |
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-111170941-B | Preparation method of 1-cyclopropyl-6, 7-difluoro-8-methoxy fluoroquinolone-3-carboxylic acid ester | 江西农业大学 | 2023-07-25 | — | — | CN | disclosed |