Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | CHRND | Q07001 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.34 |
| ▸ | ACMSD | Q8TDX5 | 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 | |
|---|---|---|---|---|
| SCHEMBL10034426 | 0.93 | MCL1 (0.39) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL21386482 | 0.89 | PDK2 (0.44) | ENPP3ENPP1MCL1ACMSDALDH1A1 | |
| SCHEMBL29407519 | 0.85 | PDK2 (0.42) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL13367457 | 0.85 | PDK2 (0.42) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL16366120 | 0.84 | CA12 (0.42) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL23137765 | 0.84 | PDK2 (0.41) | CA12CA1CA2CA9CHRNA1 | |
| SCHEMBL17574428 | 0.84 | ALDH1A1 (0.40) | CA12CA1CA2CA9SLC6A2 | |
| SCHEMBL31058374 | 0.84 | PDK2 (0.41) | CA12CA1CA2CA9CHRNA1 | |
| SCHEMBL27012236 | 0.83 | PDK2 (0.39) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL27012267 | 0.83 | ALDH1A1 (0.36) | CA12CA1CA2CA9ENPP3 |
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-2415752-B1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | IDEMITSU KOSAN CO (JP) | 2016-03-09 | — | — | EP | disclosed |