Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 18/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 18/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 18/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | SORD | Q00796 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16815492 | 0.77 | RXRA (0.42) | RXRAGRIN1GRIN2BCCR1SORD | |
| SCHEMBL16815816 | 0.76 | RXRA (0.43) | RXRAGRIN1GRIN2BCCR1 | |
| SCHEMBL21910852 | 0.75 | RXRA (0.42) | RXRAGRIN1GRIN2B | |
| SCHEMBL16815694 | 0.74 | CCR1 (0.39) | RXRAGRIN1GRIN2BCCR1 | |
| SCHEMBL16815642 | 0.74 | MAPK8 (0.44) | RXRAGRIN1GRIN2BCCR1 | |
| SCHEMBL16815405 | 0.74 | RXRA (0.41) | RXRAGRIN1GRIN2BCCR1SORD | |
| SCHEMBL20745081 | 0.73 | RXRA (0.37) | RXRAGRIN1GRIN2BCCR1 | |
| SCHEMBL16815518 | 0.73 | RXRA (0.41) | RXRAGRIN1GRIN2BCCR1 | |
| SCHEMBL16815225 | 0.72 | RXRA (0.38) | RXRAGRIN1GRIN2BCCR1 | |
| SCHEMBL16815693 | 0.71 | RXRA (0.45) | RXRAGRIN1GRIN2B |
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-2022216945-A1 | MACROCYCLIC MCL1 INHIBITORS AND USES THEREOF | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2022-10-13 | — | — | WO | disclosed |