Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29499309 | 0.82 | ADORA2A (0.43) | ADORA1ADORA2AADORA2BADORA3ALDH1A1 | |
| SCHEMBL29499403 | 0.76 | ADORA1 (0.46) | ADORA1ADORA2AADORA2BADORA3ALDH1A1 | |
| SCHEMBL9802974 | 0.75 | HSD17B13 (0.41) | ALDH1A1HSD17B10CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL924028 | 0.68 | TSHR (0.54) | ALDH1A1HSD17B10TSHRMAPTMEN1 | |
| SCHEMBL24665500 | 0.64 | HSD17B13 (0.44) | ALDH1A1 | |
| SCHEMBL10560343 | 0.64 | ADORA2A (0.43) | ADORA1ADORA2AADORA2BADORA3ALDH1A1 | |
| SCHEMBL3842559 | 0.64 | ALDH1A1 (0.45) | ALDH1A1HSD17B10TSHRCYP2C19MAPT | |
| SCHEMBL29499365 | 0.64 | ADORA2A (0.46) | ADORA1ADORA2AADORA2BADORA3ALDH1A1 | |
| SCHEMBL10376057 | 0.63 | PIK3CD (0.34) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL5800712 | 0.63 | HPGD (0.49) | CYP3A4HSD17B10CYP2D6CYP2C9CYP2C19 |
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-2022048498-A1 | USP7 INHIBITOR | 首药控股(北京)股份有限公司 | 2022-03-10 | — | — | WO | disclosed |