Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.46 |
| ▸ | KDM4D | Q6B0I6 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31330116 | 0.87 | PARP1 (0.46) | PARP1KDM4DHPGDCYP1A2MAPT | |
| SCHEMBL16695720 | 0.80 | PARP1 (0.63) | PARP1KDM4DHPGDCYP1A2MAPT | |
| SCHEMBL23500591 | 0.76 | KDM4D (0.47) | PARP1KDM4DHPGDCYP1A2MAPT | |
| SCHEMBL23500584 | 0.73 | ADORA3 (0.49) | PARP1KDM4DHPGDCYP1A2MAPT | |
| SCHEMBL16695658 | 0.73 | KDM4D (0.48) | PARP1KDM4DHPGDCYP1A2MAPT | |
| SCHEMBL31330209 | 0.72 | ADORA3 (0.53) | PARP1KDM4DHPGDMAPT | |
| SCHEMBL31330047 | 0.71 | PARP1 (0.55) | PARP1 | |
| SCHEMBL19134467 | 0.69 | PARP1 (0.50) | PARP1KDM4DCYP1A2 | |
| SCHEMBL7649821 | 0.66 | HPGD (0.45) | PARP1HPGDCYP1A2MAPTCYP2C19 | |
| SCHEMBL31330073 | 0.66 | PARP1 (0.70) | PARP1CYP1A2 |
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-119371425-A | Nitrogen-containing heterocyclic compound, preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2025-01-28 | — | — | CN | disclosed |