Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28645614 | 0.91 | ADORA2A (0.51) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28646803 | 0.87 | ADORA2A (0.61) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28647185 | 0.86 | ADORA2A (0.46) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28637791 | 0.86 | ALDH1A1 (0.57) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28658069 | 0.84 | ADORA2A (0.47) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28637601 | 0.84 | ADORA2A (0.46) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28926809 | 0.83 | ADORA2A (0.49) | ADORA2AADORA1MAPTMAPK1LMNA | |
| SCHEMBL28645393 | 0.83 | ADORA2A (0.49) | ADORA2AADORA1MAPTMAPK1LMNA | |
| SCHEMBL28637600 | 0.81 | ADORA2A (0.44) | ADORA2AADORA1MAPTALDH1A1MAPK1 | |
| SCHEMBL28637603 | 0.81 | ADORA2A (0.46) | ADORA2AADORA1MAPTALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109293652-B | Substituted thiazole derivative and application thereof | 四川科伦博泰生物医药股份有限公司 | 2021-10-22 | — | — | CN | disclosed |