Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | CHRND | Q07001 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.35 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17733224 | 0.94 | CDC25B (0.39) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL25124813 | 0.93 | CDC25B (0.39) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL16366120 | 0.91 | CA12 (0.42) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL16366594 | 0.87 | CDC25B (0.48) | ALDH1A1MAPTCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL10034426 | 0.87 | MCL1 (0.39) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL22517548 | 0.87 | ALDH1A1 (0.37) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL21386482 | 0.86 | PDK2 (0.44) | ALDH1A1MAPTMCL1ACMSDENPP3 | |
| SCHEMBL18594401 | 0.86 | PDK2 (0.40) | MAPTATMPDK2 | |
| SCHEMBL17733307 | 0.84 | PDK2 (0.40) | MAPTCDC25BATMPDK2 | |
| SCHEMBL18034393 | 0.84 | PDK2 (0.40) | MAPTCDC25BATMPDK2 |
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-3018119-A1 | AROMATIC AMINE COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | Idemitsu Kosan Co., Ltd (JP) | 2016-05-11 | — | — | EP | disclosed |