Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | FNTA | P49354 | 1/20 | 0.33 |
| ▸ | FNTB | P49356 | 1/20 | 0.33 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL509996 | 0.93 | KCNH2 (0.50) | KCNH2CYP3A4CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL509154 | 0.91 | KCNH2 (0.48) | KCNH2CYP3A4CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL1347408 | 0.90 | KCNH2 (0.48) | KCNH2CYP3A4CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL14540417 | 0.89 | KCNH2 (0.47) | KCNH2CYP3A4CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL508346 | 0.87 | KCNH2 (0.54) | KCNH2CYP3A4CYP11B1CYP11B2CYP2C9 | |
| SCHEMBL5230128 | 0.86 | KCNH2 (0.46) | KCNH2CYP3A4MGLL | |
| SCHEMBL509896 | 0.85 | KCNH2 (0.50) | KCNH2CYP3A4CYP11B1CYP11B2CYP2C9 | |
| SCHEMBL5225036 | 0.82 | LMNA (0.41) | KCNH2ALDH1A1FAAHCHRM1MAPT | |
| SCHEMBL10250900 | 0.78 | KCNH2 (0.78) | KCNH2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL509378 | 0.77 | KCNH2 (0.62) | KCNH2CYP3A4CYP2C9CYP2C19CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1377556-B1 | PYRAZOLE DERIVATIVES FOR TREATING HIV | PFIZER LTD (GB) | 2007-04-04 | — | — | EP | claimed |