Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.81 |
| ▸ | CA2 | P00918 | 1/20 | 0.81 |
| ▸ | TOP2B | Q02880 | 3/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | HPGD | P15428 | 2/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.70 |
| ▸ | MAPT | P10636 | 1/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | TOP2A | P11388 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL1444656 | 0.93 | CA1 (0.78) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL1444708 | 0.91 | CA1 (0.70) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL25193983 | 0.89 | CA1 (0.70) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL10838082 | 0.88 | KDM4E (0.78) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL10920123 | 0.87 | KDM4E (0.72) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL1445730 | 0.87 | KDM4E (0.73) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL10920267 | 0.87 | KDM4E (0.73) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL10839089 | 0.86 | KDM4E (0.81) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL29763152 | 0.86 | CA1 (0.73) | CA1CA2TOP2BKDM4EALDH1A1 | |
| SCHEMBL10837504 | 0.86 | KDM4E (0.78) | CA1CA2TOP2BKDM4EALDH1A1 |
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-2011034971-A1 | MODIFIED FLUOROQUINOLONE COMPOUNDS AND METHODS OF USING THE SAME | DESIGNMEDIX, INC. (US) | 2011-03-24 | — | — | WO | claimed |