Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 7/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28255840 | 0.85 | GFER (0.45) | KMT2AMEN1POLBRAD52GFER | |
| SCHEMBL13868460 | 0.82 | CHRM5 (0.53) | NQO2KMT2AMEN1POLBRAD52 | |
| SCHEMBL21294997 | 0.82 | CHRM5 (0.53) | NQO2KMT2AMEN1POLBRAD52 | |
| SCHEMBL28254732 | 0.81 | GFER (0.46) | KMT2AMEN1POLBRAD52GFER | |
| SCHEMBL28254766 | 0.79 | MEN1 (0.40) | NQO2KMT2AMEN1POLBRAD52 | |
| SCHEMBL28255841 | 0.77 | GFER (0.65) | NQO2KMT2AMEN1POLBGFER | |
| SCHEMBL28253899 | 0.75 | MEN1 (0.42) | KMT2AMEN1POLBRAD52GFER | |
| SCHEMBL28254690 | 0.73 | GFER (0.47) | KMT2AMEN1POLBRAD52GFER | |
| SCHEMBL21847184 | 0.71 | CYP1A2 (0.61) | ROCK2MAP4K4PRKACAROCK1DYRK1A | |
| SCHEMBL28885499 | 0.71 | CYP1A2 (0.61) | ROCK2MAP4K4PRKACAROCK1DYRK1A |
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-108863914-A | The hydrazide derivatives and application thereof that pyridine replaces | 广东东阳光药业有限公司 | 2018-11-23 | — | — | CN | disclosed |