Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.48 |
| ▸ | PDE4A | P27815 | 5/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | USP1 | O94782 | 5/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30110671 | 0.80 | ADORA3 (0.62) | ADORA2AADORA3USP1CYP3A4SMN1; SMN2 | |
| SCHEMBL12639129 | 0.79 | PDE4A (0.42) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL30110559 | 0.76 | MTOR (0.55) | CYP1A2ADORA3MEN1KMT2AUSP1 | |
| SCHEMBL23392983 | 0.76 | MTOR (0.55) | CYP1A2ADORA3MEN1KMT2AUSP1 | |
| SCHEMBL7215331 | 0.76 | ADORA3 (0.68) | CYP1A2ADORA3MEN1KMT2AUSP1 | |
| SCHEMBL1265157 | 0.76 | JAK2 (0.58) | ADORA2AADORA3USP1ADORA1 | |
| SCHEMBL28671352 | 0.74 | PDE4A (0.46) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8405232 | 0.71 | ADORA2A (0.46) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL21285531 | 0.71 | CYP1A2 (0.49) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL10370575 | 0.70 | EEF2K (0.52) | ADORA2APDE4APDE4BPDE4CPDE4D |
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-2022262784-A1 | IDH MUTANT INHIBITOR AND USE THEREOF | 微境生物医药科技(上海)有限公司 | 2022-12-22 | — | — | WO | disclosed |