Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 8/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | TOP2A | P11388 | 4/20 | 0.34 |
| ▸ | TOP2B | Q02880 | 4/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.33 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6502180 | 0.91 | KCNH2 (0.60) | KCNH2CYP3A4ALDH1A1POLBOPRM1 | |
| SCHEMBL6507753 | 0.86 | KCNH2 (0.60) | KCNH2ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL6503701 | 0.80 | KCNH2 (0.60) | KCNH2ALDH1A1POLBOPRM1GSK3B | |
| SCHEMBL6528463 | 0.80 | KCNH2 (0.65) | KCNH2CYP3A4ALDH1A1POLBCHRM2 | |
| SCHEMBL6502846 | 0.77 | KCNH2 (0.50) | KCNH2CYP3A4ALDH1A1POLBCHRM2 | |
| SCHEMBL2082885 | 0.76 | CYP3A4 (0.65) | KCNH2CYP3A4ALDH1A1POLBCHRM2 | |
| SCHEMBL2082888 | 0.76 | CYP3A4 (0.65) | KCNH2CYP3A4ALDH1A1POLBCHRM2 | |
| SCHEMBL6530621 | 0.76 | KCNH2 (0.52) | KCNH2CYP3A4ALDH1A1POLBCHRM2 | |
| SCHEMBL6530386 | 0.75 | KCNH2 (0.56) | KCNH2CYP3A4ALDH1A1POLBCHRM2 | |
| SCHEMBL6530656 | 0.74 | KCNH2 (0.54) | KCNH2CYP3A4ALDH1A1POLBCHRM2 |
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-2005049602-A1 | QUINOLONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2005-06-02 | — | — | WO | disclosed |