Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ1 | P51787 | 1/20 | 0.46 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | BDKRB1 | P46663 | 6/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | REN | P00797 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL630006 | 0.90 | KCNQ1 (0.53) | KCNQ1HCRTR1HCRTR2CTSSCTSL | |
| SCHEMBL1383175 | 0.90 | KCNQ1 (0.53) | KCNQ1HCRTR1HCRTR2CTSSCTSL | |
| SCHEMBL630823 | 0.85 | KCNQ1 (0.49) | KCNQ1HCRTR1HCRTR2BDKRB1ALDH1A1 | |
| SCHEMBL631050 | 0.83 | KCNQ1 (0.47) | KCNQ1HCRTR1HCRTR2BDKRB1ALDH1A1 | |
| SCHEMBL630680 | 0.82 | KCNQ1 (0.48) | KCNQ1HCRTR1HCRTR2CTSSCTSL | |
| SCHEMBL631034 | 0.81 | KCNQ1 (0.44) | KCNQ1HCRTR1HCRTR2BDKRB1POLB | |
| SCHEMBL630055 | 0.81 | KCNQ1 (0.47) | KCNQ1HCRTR1HCRTR2CTSSCTSL | |
| SCHEMBL631253 | 0.77 | BDKRB1 (0.42) | KCNQ1BDKRB1POLB | |
| SCHEMBL631454 | 0.76 | BDKRB1 (0.45) | KCNQ1BDKRB1SMN1; SMN2NPSR1GAA | |
| SCHEMBL630671 | 0.76 | POLB (0.46) | KCNQ1HCRTR1HCRTR2BDKRB1ALDH1A1 |
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-1778637-B1 | FKBP-binding composition and pharmaceutical use thereof | AVENTIS PHARMA INC (US) | 2012-02-22 | — | — | EP | claimed |