Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 2/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | SCN1A | P35498 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 4/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3524292 | 0.84 | CHRNB4 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4LTA4H | |
| SCHEMBL3524296 | 0.84 | CHRNB4 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4LTA4H | |
| SCHEMBL21312467 | 0.73 | CHRNB4 (0.47) | CHRNB4CHRNA3CHRNB2CHRNA4LTA4H | |
| SCHEMBL8927176 | 0.71 | CHRNB4 (0.55) | CHRNB4CHRNA3CHRNB2CHRNA4LTA4H | |
| SCHEMBL3527734 | 0.70 | MEN1 (0.43) | KIF11CNR1 | |
| SCHEMBL3520415 | 0.70 | MEN1 (0.43) | KIF11CNR1 | |
| SCHEMBL23031978 | 0.70 | CHRNB4 (0.40) | CHRNB4CHRNA3CHRNB2CHRNA4LTA4H | |
| SCHEMBL24119502 | 0.68 | CHRNB4 (0.39) | CHRNB4CHRNA3CHRNB2CHRNA4LTA4H | |
| SCHEMBL3525258 | 0.66 | CNR1 (0.47) | LTA4HCNR1 | |
| SCHEMBL11268533 | 0.64 | DRD2 (0.48) | — |
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-1725232-B1 | (INDOL-3-YL)-HETEROCYCLE DERIVATIVES AS AGONISTS OF THE CANNABINOID CB1 RECEPTOR | ORGANON NV (NL) | 2008-01-23 | — | — | EP | disclosed |