Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | YAP1 | P46937 | 1/20 | 0.37 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 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 | |
|---|---|---|---|---|
| SCHEMBL4598116 | 0.90 | NR1H2 (0.42) | ESR2GPR119CHRM2CHRM4CHRM5 | |
| SCHEMBL951850 | 0.80 | ESR2 (0.48) | ESR2GPR119CHRM2CHRM4CHRM5 | |
| SCHEMBL952114 | 0.79 | ESR2 (0.45) | ESR2CHRM5CHRM1PTPN2PTPN1 | |
| SCHEMBL25262018 | 0.79 | ESR2 (0.45) | ESR2GPR119CHRM5CHRM1PTPN2 | |
| SCHEMBL4598184 | 0.79 | GPR119 (0.38) | GPR119 | |
| SCHEMBL5717213 | 0.75 | KDM4E (0.59) | GPR119KDM4EPKMYAP1JAK2 | |
| SCHEMBL4597034 | 0.75 | ESR2 (0.39) | ESR2GPR119PTPN2PTPN1PTPN6 | |
| SCHEMBL3096155 | 0.75 | CHRM5 (0.39) | ESR2GPR119CHRM2CHRM4CHRM5 | |
| SCHEMBL8264285 | 0.74 | ESR2 (0.54) | ESR2GPR119NR1H2 | |
| SCHEMBL7871022 | 0.73 | GPR119 (0.49) | GPR119 |
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-1908471-A1 | Tetrahydropyridines as renin inhibitors | Speedel Experimenta AG (CH) | 2008-04-09 | — | — | EP | disclosed |