Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 3/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | REN | P00797 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | PDE9A | O76083 | 1/20 | 0.36 |
| ▸ | HPGDS | O60760 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1474674 | 0.83 | CHRM1 (0.48) | KCNA5ADRA1DADRA1AADRA1BCHRM1 | |
| SCHEMBL27618092 | 0.73 | SLC6A2 (0.31) | CHRM1CHRM3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27617849 | 0.72 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3735688 | 0.72 | KCNA5 (0.59) | KCNA5ALDH1A1CYP1A2MKNK1MKNK2 | |
| SCHEMBL27599730 | 0.71 | KCNA5 (0.50) | KCNA5ADRA1DADRA1AADRA1BCHRM1 | |
| SCHEMBL4138378 | 0.71 | CHRNB2 (0.54) | KCNA5ADRA1DADRA1AADRA1BCHRM1 | |
| SCHEMBL4138380 | 0.71 | CHRNB2 (0.54) | KCNA5ADRA1DADRA1AADRA1BCHRM1 | |
| SCHEMBL2175358 | 0.70 | KCNA5 (0.54) | KCNA5ALDH1A1CYP1A2MKNK1MKNK2 | |
| SCHEMBL12748467 | 0.70 | CHRM3 (0.54) | CHRM1CHRM3KCNH2SLC6A2SLC6A4 | |
| SCHEMBL27618116 | 0.70 | SLC6A2 (0.45) | KCNH2SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100389113-C | Nitrogen-containing heterocyclic compound and drug containing same | EISAI CO LTD (JP) | 2008-05-21 | — | — | CN | disclosed |
| CN-1630650-A | Nitrogen-containing heterocyclic compound and drug containing same | EISAI CO LTD (JP) | 2005-06-22 | — | — | CN | disclosed |