Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SREBF2 | Q12772 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.43 |
| ▸ | ATR | Q13535 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28152360 | 0.84 | SREBF2 (0.44) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL23168284 | 0.83 | SREBF2 (0.47) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL30955414 | 0.82 | ATR (0.49) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL30000904 | 0.81 | ATR (0.44) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL28259603 | 0.81 | NAMPT (0.44) | SREBF2CYP17A1AURKARPS6KB1NAMPT | |
| SCHEMBL30955481 | 0.81 | SREBF2 (0.44) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL30530884 | 0.80 | SREBF2 (0.45) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL30955401 | 0.79 | SREBF2 (0.48) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL6591045 | 0.79 | SREBF2 (0.49) | SREBF2CYP17A1ATRAURKARPS6KB1 | |
| SCHEMBL28356003 | 0.78 | ACSS2 (0.42) | SREBF2CYP17A1ATRAURKARPS6KB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109071444-A | N- (cyanobenzyl) -6- (cyclopropyl-carbonylamino) -4- (phenyl) -pyridine-2-carboxamide derivatives and related compounds as pesticides and plant protection agents | 拜耳作物科学股份公司 | 2018-12-21 | — | — | CN | disclosed |