Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 5/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 4/20 | 0.32 |
| ▸ | ACACB | O00763 | 7/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.32 |
| ▸ | PTGIR | P43119 | 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 | |
|---|---|---|---|---|
| SCHEMBL24095593 | 0.73 | P2RX3 (0.39) | CNR2P2RX3 | |
| SCHEMBL24095591 | 0.70 | — | — | |
| SCHEMBL24095550 | 0.68 | MDM2 (0.37) | MDM2 | |
| SCHEMBL24095548 | 0.68 | FFAR4 (0.36) | MDM2ACHECNR2 | |
| SCHEMBL24096022 | 0.67 | MDM2 (0.32) | MDM2 | |
| SCHEMBL19375130 | 0.66 | ALDH1A1 (0.34) | MDM2 | |
| SCHEMBL24095547 | 0.66 | MDM2 (0.35) | MDM2CNR2P2RX3 | |
| SCHEMBL24096010 | 0.66 | ADORA3 (0.42) | — | |
| SCHEMBL24095919 | 0.64 | ACACB (0.36) | ACACB | |
| SCHEMBL20656233 | 0.64 | ADORA3 (0.49) | — |
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 |