Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 9/20 | 0.86 |
| ▸ | NOS3 | P29474 | 8/20 | 0.86 |
| ▸ | NOS1 | P29475 | 5/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | CCR8 | P51685 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | F12 | P00748 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | NCF1 | P14598 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 2/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | PRKDC | P78527 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29814771 | 0.93 | — | — | |
| SCHEMBL34938 | 0.93 | — | — | |
| Zinc Ion SCHEMBL30519352 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| SCHEMBL29101191 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| Bromide SCHEMBL28053084 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| SCHEMBL30482664 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| Hydrochloric Acid SCHEMBL11719745 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| SCHEMBL30454704 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| SCHEMBL28572816 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 | |
| SCHEMBL28237608 | 0.91 | NOS2 (0.95) | NOS2NOS3NOS1CCR1CCR5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1185202-C | Process for preparation of acylated 1,3-dicarbonyl compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2005-01-19 | — | — | CN | disclosed |
| CN-1368947-A | Process for preparation of acylated 1,3-dicarbonyl compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2002-09-11 | — | — | CN | disclosed |