Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 3/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.34 |
| ▸ | PDE1A | P54750 | 2/20 | 0.34 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | PKLR | P30613 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PNP | P00491 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30066981 | 0.85 | ACACB (0.37) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL22533722 | 0.85 | ACACB (0.37) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL22533809 | 0.83 | MAPT (0.34) | ACACBENPP1LMNAALDH1A1MAPT | |
| SCHEMBL29424809 | 0.83 | MAPT (0.34) | ACACBENPP1LMNAALDH1A1MAPT | |
| SCHEMBL22533471 | 0.81 | ACACB (0.40) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL27442082 | 0.81 | ACACB (0.40) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL29424700 | 0.81 | ACACB (0.40) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL28723176 | 0.80 | ACACB (0.40) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL22547791 | 0.77 | ACACB (0.37) | ACACBCNR1CNR2NPBWR1PDE1A | |
| SCHEMBL25235955 | 0.70 | NPBWR1 (0.50) | CNR1CNR2NPBWR1PDE1APDE1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3952995-A1 | BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS | Riboscience LLC (US) | 2022-02-16 | — | — | EP | disclosed |
| WO-2020210649-A1 | BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS | RIBOSCIENCE LLC (US) | 2020-10-15 | — | — | WO | disclosed |