Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.44 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.38 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL3724962 | 0.91 | HSD11B1 (0.38) | HSD11B1TNKSPARP1PARP2SCN1A | |
| SCHEMBL4739224 | 0.87 | KDM4E (0.48) | SCN1ASCN5ASCN9AADRA1DADRA1A | |
| SCHEMBL4738085 | 0.86 | TNKS (0.42) | HSD11B1TNKSPARP1PARP2SCN1A | |
| SCHEMBL4675598 | 0.83 | CYP3A4 (0.40) | HSD11B1TNKSPARP1PARP2 | |
| SCHEMBL3403017 | 0.82 | OPRM1 (0.50) | ADRA1APLD1ALDH1A1CHRM1HTR2A | |
| SCHEMBL1835272 | 0.82 | OPRM1 (0.50) | ADRA1APLD1ALDH1A1CHRM1HTR2A | |
| SCHEMBL4676169 | 0.82 | HSD11B1 (0.46) | HSD11B1TNKSPARP1PARP2SCN1A | |
| SCHEMBL4676172 | 0.82 | HSD11B1 (0.46) | HSD11B1TNKSPARP1PARP2SCN1A | |
| SCHEMBL3398375 | 0.80 | CACNA1G (0.35) | HSD11B1 | |
| SCHEMBL3665332 | 0.80 | POLB (0.35) | ALDH1A1CHRM5 |
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 |