Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 6/20 | 0.42 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18021179 | 0.96 | SIGMAR1 (0.40) | SIGMAR1KCNH2KCNJ1CCR2LMNA | |
| SCHEMBL18021171 | 0.90 | SIGMAR1 (0.47) | SIGMAR1KCNH2KCNJ1LMNAGAA | |
| SCHEMBL18022814 | 0.89 | KCNJ1 (0.46) | SIGMAR1KCNH2KCNJ1CCR2SMN1; SMN2 | |
| SCHEMBL18022817 | 0.86 | KCNJ1 (0.43) | SIGMAR1KCNH2KCNJ1CCR2SMN1; SMN2 | |
| SCHEMBL18021170 | 0.86 | SIGMAR1 (0.43) | SIGMAR1KCNH2KCNJ1SMN1; SMN2L3MBTL1 | |
| SCHEMBL463473 | 0.84 | LMNA (0.44) | SIGMAR1KCNH2KCNJ1LMNASMN1; SMN2 | |
| SCHEMBL409694 | 0.82 | ALDH1A1 (0.43) | KCNH2KCNJ1LMNAGAASMN1; SMN2 | |
| SCHEMBL18021164 | 0.80 | SIGMAR1 (0.44) | SIGMAR1KCNH2KCNJ1CCR2SMN1; SMN2 | |
| SCHEMBL18021169 | 0.80 | SIGMAR1 (0.41) | SIGMAR1KCNH2KCNJ1CCR2CCR5 | |
| SCHEMBL18021168 | 0.79 | SIGMAR1 (0.45) | SIGMAR1KCNH2KCNJ1CCR2SMN1; SMN2 |
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-2015051362-A1 | MULTIFUNCTIONAL CHELATORS, COMPLEXES, AND COMPOSITIONS THEREOF, AND METHODS OF USING SAME | ILLINOIS INSTITUTE OF TECHNOLOGY (US) | 2015-04-09 | — | — | WO | disclosed |