Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 16/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24095821 | 0.86 | P2RX3 (0.35) | GPBAR1MDM2CNR2FFAR4 | |
| SCHEMBL24095550 | 0.79 | MDM2 (0.37) | GPBAR1MDM2 | |
| SCHEMBL24095567 | 0.78 | ACACB (0.32) | CNR2FFAR4ACACB | |
| SCHEMBL20656234 | 0.77 | P2RX3 (0.33) | GPBAR1FFAR4 | |
| SCHEMBL24095563 | 0.77 | P2RX3 (0.33) | — | |
| SCHEMBL24095600 | 0.77 | CNR2 (0.35) | GPBAR1MDM2CNR2FFAR4 | |
| SCHEMBL24095630 | 0.76 | TP53 (0.35) | FFAR4 | |
| SCHEMBL20655944 | 0.76 | FFAR4 (0.34) | GPBAR1MDM2CNR2FFAR4ACACB | |
| SCHEMBL20656230 | 0.75 | USP1 (0.34) | FFAR4 | |
| SCHEMBL24095548 | 0.74 | FFAR4 (0.36) | GPBAR1MDM2CNR2FFAR4 |
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-3652176-B1 | SUBSTITUTED XANTHINE DERIVATIVES | BOEHRINGER INGELHEIM INT (DE) | 2021-12-15 | — | — | EP | disclosed |