Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.37 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL21837833 | 0.89 | KIF11 (0.39) | KIF11TSHRSLC6A1SLC6A11TDP1 | |
| SCHEMBL21837835 | 0.89 | KIF11 (0.39) | KIF11TSHRSLC6A1SLC6A11TDP1 | |
| SCHEMBL21837995 | 0.82 | TSHR (0.35) | KIF11TSHRSLC6A1SLC6A11TDP1 | |
| SCHEMBL21837994 | 0.82 | TSHR (0.35) | KIF11TSHRSLC6A1SLC6A11TDP1 | |
| SCHEMBL21895929 | 0.76 | KIF11 (0.33) | KIF11SLC6A1SLC6A11 | |
| SCHEMBL24937040 | 0.71 | LMNA (0.46) | KIF11SLC6A1SLC6A11KCNH2 | |
| SCHEMBL4024357 | 0.71 | KIF11 (0.44) | KIF11SLC6A1SLC6A11KCNH2 | |
| SCHEMBL10434128 | 0.71 | LMNA (0.46) | KIF11SLC6A1SLC6A11KCNH2 | |
| SCHEMBL10434091 | 0.71 | LMNA (0.46) | KIF11SLC6A1SLC6A11KCNH2 | |
| SCHEMBL25713808 | 0.71 | KIF11 (0.51) | KIF11SLC6A1SLC6A11KCNH2KDM4E |
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-3636807-A1 | CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME | Chugai Seiyaku Kabushiki Kaisha (JP) | 2020-04-15 | — | — | EP | disclosed |