Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TNKS | O95271 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | CDYL | Q9Y232 | 3/20 | 0.36 |
| ▸ | CBX7 | O95931 | 2/20 | 0.36 |
| ▸ | CDYL2 | Q8N8U2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4675596 | 0.84 | CYP3A4 (0.40) | HSD11B1CHRM1TNKSPARP1PARP2 | |
| SCHEMBL4676172 | 0.83 | HSD11B1 (0.46) | HSD11B1SCN1ASCN5ASCN9APLD1 | |
| SCHEMBL4676169 | 0.83 | HSD11B1 (0.46) | HSD11B1SCN1ASCN5ASCN9APLD1 | |
| SCHEMBL3803735 | 0.82 | OPRM1 (0.49) | HSD11B1PLD1CHRM4CHRM5CHRM1 | |
| SCHEMBL4674536 | 0.81 | PTGDR2 (0.35) | CHRM1 | |
| SCHEMBL4681956 | 0.79 | OPRL1 (0.48) | — | |
| SCHEMBL4678001 | 0.78 | FPR2 (0.42) | POLB | |
| SCHEMBL4682261 | 0.78 | DRD2 (0.44) | CHRM1ALDH1A1KMT2A | |
| SCHEMBL4674480 | 0.78 | ALDH1A1 (0.44) | CHRM4ALDH1A1TNKSPARP1PARP2 | |
| SCHEMBL4682963 | 0.76 | CHRM1 (0.51) | SCN5APLD1CHRM1MEN1KMT2A |
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-1997805-A1 | Compounds with antiparasitic activity, applications thereof to the treatment of infectious diseases caused by apicomplexans | Commissariat à l'Energie Atomique (FR) | 2008-12-03 | — | — | EP | disclosed |