Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | CCNC | P24863 | 1/20 | 0.31 |
| ▸ | CDK8 | P49336 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22015071 | 0.85 | TBXA2R (0.34) | CYP3A4P2RX7CYP2D6HTTKMT2A | |
| SCHEMBL22015234 | 0.79 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPTRPS6KB2LMNA | |
| SCHEMBL22015899 | 0.78 | NPC1 (0.36) | ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL22340702 | 0.75 | CYP2D6 (0.43) | CYP3A4AAK1PRKACAROCK1ALDH1A1 | |
| SCHEMBL22340676 | 0.67 | CYP2D6 (0.43) | CYP3A4AAK1PRKACAROCK1ALDH1A1 | |
| SCHEMBL20753603 | 0.67 | CYP2D6 (0.38) | CYP3A4AAK1PRKACAROCK1ALDH1A1 | |
| SCHEMBL22020526 | 0.66 | HDAC4 (0.34) | ALDH1A1SMN1; SMN2MAPTLMNAHTT | |
| SCHEMBL22014606 | 0.65 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2RPS6KB2LMNAKMT2A | |
| SCHEMBL17204708 | 0.65 | KDM4E (0.45) | CYP3A4PRKACAROCK1ALDH1A1MAPT | |
| SCHEMBL22015230 | 0.63 | ALDH1A1 (0.36) | CYP3A4ALDH1A1SMN1; SMN2CTNNB1WNT3A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020099407-A1 | HERBICIDAL COMPOUNDS | SYNGENTA CROP PROTECTION AG (CH) | 2020-05-22 | — | — | WO | disclosed |