Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PRKCZ | Q05513 | 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 | |
|---|---|---|---|---|
| SCHEMBL22646308 | 0.84 | ALDH1A1 (0.39) | ALDH1A1MAPK1PTGS2PTGS1CDK2 | |
| SCHEMBL21869103 | 0.77 | ALDH1A1 (0.37) | ALDH1A1MAPK1HSD17B10 | |
| SCHEMBL21869151 | 0.70 | SLC10A1 (0.52) | — | |
| SCHEMBL21868966 | 0.70 | SMARCA2 (0.42) | PTGS2PTGS1 | |
| SCHEMBL21869178 | 0.68 | SCN10A (0.42) | — | |
| SCHEMBL21869337 | 0.63 | SLC10A1 (0.33) | ALDH1A1MAPK1PTGS2PTGS1CDK2 | |
| SCHEMBL24890429 | 0.62 | MAPK1 (0.38) | ALDH1A1MAPK1KDM4EMEN1MAPT | |
| SCHEMBL21378308 | 0.62 | MAPK1 (0.60) | ALDH1A1MAPK1KDM4EMEN1MAPT | |
| SCHEMBL21378269 | 0.60 | MAPK1 (0.57) | ALDH1A1MAPK1KDM4EMEN1MAPT | |
| SCHEMBL21378233 | 0.60 | KMT2A (0.44) | ALDH1A1MAPK1KDM4EMEN1MAPT |
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-3628674-A1 | BICYCLIC NUCLEOCAPSID INHIBITOR AND USE OF SAME AS DRUG IN TREATMENT OF HEPATITIS B | Shanghai Longwood Biopharmaceuticals Co., Ltd. (CN) | 2020-04-01 | — | — | EP | disclosed |