Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.63 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.58 |
| ▸ | MMP12 | P39900 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 7/20 | 0.49 |
| ▸ | DRD2 | P14416 | 6/20 | 0.49 |
| ▸ | DRD3 | P35462 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11002313 | 0.81 | PARP1 (0.77) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL532134 | 0.78 | PARP1 (1.00) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL351961 | 0.78 | PARP1 (0.72) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL554735 | 0.78 | PARP1 (0.72) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL28693938 | 0.78 | PARP1 (0.72) | PARP1NR3C2MMP12DRD4DRD2 | |
| Hydrochloric Acid SCHEMBL3557170 | 0.77 | PARP1 (0.70) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL11006154 | 0.77 | PARP1 (0.70) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL11004751 | 0.77 | PARP1 (0.70) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL9244955 | 0.76 | PARP1 (0.65) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL4263588 | 0.76 | PARP1 (0.65) | PARP1NR3C2MMP12DRD4DRD2 |
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-113999232-A | MAT2A inhibitors | 南京正大天晴制药有限公司 | 2022-02-01 | — | — | CN | disclosed |