Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NOS3 | P29474 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | NOS2 | P35228 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | FPR2 | P25090 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21274381 | 0.80 | CA2 (0.64) | CYP2C9CYP2C19KEAP1KMT2AMEN1 | |
| SCHEMBL21274384 | 0.80 | CA2 (0.64) | CYP2C9CYP2C19KEAP1KMT2AMEN1 | |
| SCHEMBL27384186 | 0.80 | ALDH1A1 (0.50) | CYP2C9CYP2C19NOS3NOS1NOS2 | |
| SCHEMBL10872082 | 0.79 | ALDH1A1 (0.51) | CYP2C9CYP2C19KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL10872087 | 0.79 | ALDH1A1 (0.51) | CYP2C9CYP2C19KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL6474415 | 0.78 | CYP2C9 (0.47) | CYP2C9CYP2C19CNR2KEAP1FPR2 | |
| SCHEMBL359065 | 0.78 | ALDH1A1 (0.66) | CYP2C9CYP2C19FPR2KMT2AMEN1 | |
| SCHEMBL6026558 | 0.78 | ALDH1A1 (0.66) | CYP2C9CYP2C19FPR2KMT2AMEN1 | |
| SCHEMBL6026559 | 0.78 | ALDH1A1 (0.66) | CYP2C9CYP2C19FPR2KMT2AMEN1 | |
| SCHEMBL9502850 | 0.78 | ALDH1A1 (0.66) | CYP2C9CYP2C19FPR2KMT2AMEN1 |
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-1080258-C | 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives as pesticides | BAYER AG (DE) | 2002-03-06 | — | — | CN | disclosed |