Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 17/20 | 0.81 |
| ▸ | CNR1 | P21554 | 9/20 | 0.81 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | HTR3A | P46098 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL31052991 | 1.00 | CNR2 (0.81) | CNR2CNR1HDAC1HDAC6HTR3A | |
| SCHEMBL17297543 | 0.99 | CNR2 (0.80) | CNR2CNR1HDAC1HDAC6 | |
| SCHEMBL13502771 | 0.90 | CNR2 (0.81) | CNR2CNR1HDAC1HDAC6 | |
| SCHEMBL16755272 | 0.90 | CNR2 (1.00) | CNR2CNR1 | |
| SCHEMBL29359055 | 0.90 | CNR2 (1.00) | CNR2CNR1 | |
| SCHEMBL13502770 | 0.90 | CNR2 (0.81) | CNR2CNR1HDAC1HDAC6 | |
| SCHEMBL17388191 | 0.89 | CNR2 (0.81) | CNR2CNR1HDAC1HDAC6 | |
| SCHEMBL29019200 | 0.89 | CNR2 (0.80) | CNR2CNR1HDAC1HDAC6 | |
| SCHEMBL17388587 | 0.88 | CNR2 (0.79) | CNR2CNR1HDAC1HDAC6 | |
| SCHEMBL13502769 | 0.87 | CNR2 (0.77) | CNR2CNR1HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220026380-A1 | NUCLEAR MAGNETIC RESONANCE IMPLEMENTED SYNTHETIC INDOLE AND INDAZOLE CANNABINOID DETECTION, IDENTIFICATION, AND QUANTIFICATION | HOFSTRA UNIVERSITY (US) | 2022-01-27 | — | — | US | disclosed |