Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 9/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12957276 | 0.83 | NCF1 (0.54) | NCF1ALDH1A1KDM4EGPBAR1CYSLTR2 | |
| SCHEMBL20909590 | 0.80 | NCF1 (0.49) | NCF1PDE2AALDH1A1GFERKDM4E | |
| SCHEMBL20909360 | 0.80 | NCF1 (0.51) | NCF1ALDH1A1GFERKDM4EGPBAR1 | |
| SCHEMBL2320403 | 0.79 | NCF1 (0.53) | NCF1ALDH1A1KDM4E | |
| SCHEMBL22590545 | 0.79 | CYP3A4 (0.56) | NCF1MCHR1ALDH1A1 | |
| SCHEMBL22982775 | 0.77 | ALDH1A1 (0.53) | NCF1MAOBALDH1A1GFERKDM4E | |
| SCHEMBL20909617 | 0.77 | NCF1 (0.49) | NCF1GPBAR1CYSLTR2CYSLTR1 | |
| SCHEMBL20909344 | 0.77 | NCF1 (0.49) | NCF1PDE2AALDH1A1KDM4EGPBAR1 | |
| SCHEMBL22982646 | 0.76 | PPARA (0.44) | MAOBALDH1A1GFERKDM4E | |
| SCHEMBL29862304 | 0.76 | PPARA (0.44) | MAOBALDH1A1GFERKDM4E |
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-114585628-B | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2024-03-26 | — | — | CN | disclosed |