Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | CETP | P11597 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4749538 | 0.98 | KCNH2 (0.51) | SIGMAR1KCNH2HTR2ACSNK1ECNR2 | |
| SCHEMBL2854089 | 0.98 | KCNH2 (0.51) | SIGMAR1KCNH2HTR2ACSNK1ECNR2 | |
| SCHEMBL2790330 | 0.94 | KCNH2 (0.46) | SIGMAR1KCNH2HTR2ACNR2CHRM2 | |
| SCHEMBL18093956 | 0.91 | SIGMAR1 (0.49) | SIGMAR1KCNH2CHRM2HTR1AADRA2A | |
| SCHEMBL11785905 | 0.87 | SIGMAR1 (0.50) | SIGMAR1KCNH2HTR2A | |
| SCHEMBL1128437 | 0.85 | SIGMAR1 (0.46) | SIGMAR1KCNH2CHRM2HTR1AADRA2A | |
| SCHEMBL11785493 | 0.81 | SIGMAR1 (0.47) | SIGMAR1KCNH2 | |
| SCHEMBL3322171 | 0.81 | KCNH2 (0.53) | SIGMAR1KCNH2HTR2ACSNK1ECHRM2 | |
| SCHEMBL28523845 | 0.81 | CSNK1E (0.57) | CSNK1ECNR2 | |
| SCHEMBL1678339 | 0.81 | KCNH2 (0.53) | SIGMAR1KCNH2HTR2ACNR2CETP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003040074-A1 | LIQUID CRYSTALLINE COMPOUNDS CONTAINING A BIPHENYL CORE | QINETIQ LIMITED (GB) | 2003-05-15 | — | — | WO | disclosed |