Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 4/20 | 0.37 |
| ▸ | CCR4 | P51679 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
| ▸ | HTR5A | P47898 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21035618 | 0.88 | CA12 (0.41) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21035612 | 0.82 | GHSR (0.38) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21035615 | 0.82 | GHSR (0.38) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21035614 | 0.82 | GHSR (0.38) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21035398 | 0.81 | HTR1A (0.42) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21035317 | 0.81 | HTR1A (0.42) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21034999 | 0.76 | ITGB1 (0.47) | ITGB1ITGA4HCRTR1HCRTR2HTR1A | |
| SCHEMBL21034994 | 0.76 | ITGB1 (0.47) | ITGB1ITGA4HCRTR1HCRTR2HTR1A | |
| SCHEMBL21035399 | 0.76 | HTR1A (0.44) | CNR2ITGB1ITGA4HCRTR1HCRTR2 | |
| SCHEMBL21035314 | 0.76 | HTR1A (0.44) | CNR2ITGB1ITGA4HCRTR1HCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019104011-A1 | CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE | BIOMARIN PHARMACEUTICAL INC. (US) | 2019-05-31 | — | — | WO | disclosed |