Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 8/20 | 0.33 |
| ▸ | PDE4A | P27815 | 3/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23915570 | 0.80 | CNR2 (0.39) | AAK1CNR2SCN9ADHFRRIPK1 | |
| SCHEMBL23966851 | 0.80 | TRPA1 (0.37) | CNR2PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL29311606 | 0.75 | HTR7 (0.44) | KDM4EALDH1A1HTR2A | |
| SCHEMBL16738735 | 0.74 | MCHR1 (0.42) | AAK1SCN9AHTR2C | |
| SCHEMBL23966794 | 0.70 | CNR2 (0.35) | AAK1CNR2SCN9ADHFRRIPK1 | |
| SCHEMBL16650978 | 0.68 | RIPK1 (0.41) | RIPK1HTR2AHTR2CHTR2B | |
| SCHEMBL23966507 | 0.68 | KDM4E (0.39) | KDM4EALDH1A1RIPK1HTR2AHTR2C | |
| SCHEMBL983574 | 0.68 | EGFR (0.39) | PDE4BPDE4DHTR2AHTR2CHTR2B | |
| SCHEMBL15871 | 0.68 | HTR2A (0.40) | CNR2PDE4BPDE4DKDM4EALDH1A1 | |
| SCHEMBL21957402 | 0.67 | SCD (0.42) | CNR2SCN9ARIPK1HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-3649119-B1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS | GALAPAGOS NV (BE) | 2021-11-03 | — | — | EP | disclosed |