Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 9/20 | 0.48 |
| ▸ | PDE1B | Q01064 | 4/20 | 0.46 |
| ▸ | PDE1A | P54750 | 3/20 | 0.46 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29071647 | 1.00 | NPBWR1 (0.48) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL30731296 | 0.84 | NPBWR1 (0.52) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL15545682 | 0.84 | NPBWR1 (0.52) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL21796911 | 0.83 | NPBWR1 (0.48) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL21796474 | 0.79 | NPBWR1 (0.44) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL22553999 | 0.79 | CNR2 (0.55) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL30731305 | 0.79 | CNR2 (0.55) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL2961568 | 0.78 | PDE1B (0.52) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL17395029 | 0.78 | NPBWR1 (0.48) | NPBWR1PDE1BPDE1APDE1CMCHR1 | |
| SCHEMBL5091051 | 0.77 | BRD4 (0.53) | NPBWR1PDE1BPDE1APDE1CMCHR1 |
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-116535401-A | Novel PARP1 inhibitors and uses thereof | 南京圣和药业股份有限公司 | 2023-08-04 | — | — | CN | disclosed |