Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26962454 | 1.00 | GPR3 (0.38) | GPR3PARP1PARP10SRD5A1TYMS | |
| SCHEMBL29690456 | 1.00 | GPR3 (0.38) | GPR3PARP1PARP10SRD5A1TYMS | |
| SCHEMBL26962621 | 0.88 | GPR3 (0.38) | GPR3SRD5A1 | |
| SCHEMBL22374934 | 0.88 | GPR3 (0.38) | GPR3SRD5A1 | |
| SCHEMBL20305455 | 0.88 | GPR3 (0.38) | GPR3SRD5A1 | |
| SCHEMBL29689960 | 0.88 | GPR3 (0.38) | GPR3SRD5A1 | |
| SCHEMBL14846082 | 0.84 | PARP1 (0.41) | GPR3PARP1PARP10 | |
| SCHEMBL14829263 | 0.84 | PARP1 (0.41) | GPR3PARP1PARP10 | |
| SCHEMBL14829264 | 0.84 | PARP1 (0.41) | GPR3PARP1PARP10 | |
| SCHEMBL15320910 | 0.84 | PARP1 (0.41) | GPR3PARP1PARP10 |
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-114539257-B | Pyrimidine diketone spiro derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2023-08-11 | — | — | CN | disclosed |
| CN-114539257-A | Pyrimidinedione spiro derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-05-27 | — | — | CN | disclosed |