Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 9/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 3/20 | 0.36 |
| ▸ | TOP2B | Q02880 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6526859 | 0.90 | KCNH2 (0.70) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6530311 | 0.89 | KCNH2 (0.61) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6530386 | 0.85 | KCNH2 (0.56) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6529788 | 0.85 | KCNH2 (0.69) | KCNH2ALDH1A1POLBOPRM1CHRM2 | |
| SCHEMBL6530323 | 0.85 | KCNH2 (0.46) | KCNH2ALDH1A1POLBOPRM1CHRM2 | |
| SCHEMBL6528463 | 0.82 | KCNH2 (0.65) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6527941 | 0.79 | KCNH2 (0.79) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6371511 | 0.79 | KCNH2 (0.59) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6528060 | 0.79 | KCNH2 (0.70) | KCNH2ALDH1A1POLBOPRM1CHRM2 | |
| SCHEMBL6499864 | 0.79 | KCNH2 (0.53) | KCNH2CYP3A4ALDH1A1POLBOPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005049602-A1 | QUINOLONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2005-06-02 | — | — | WO | claimed |
| WO-2005049602-A1 | QUINOLONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2005-06-02 | — | — | WO | disclosed |