Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TYMP | P19971 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 7/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | ROS1 | P08922 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27829237 | 0.92 | DRD2 (0.42) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL12264736 | 0.89 | DGAT1 (0.38) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL941529 | 0.88 | LMNA (0.46) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL12264732 | 0.82 | LMNA (0.42) | LMNATHRBCYP2C19CA12CA1 | |
| SCHEMBL12427963 | 0.81 | TYMP (0.43) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL12427881 | 0.81 | TYMP (0.43) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL943184 | 0.81 | TYMP (0.43) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL12264734 | 0.78 | CYP3A4 (0.35) | EGFRCYP3A4CYP2D6OPRK1JAK2 | |
| SCHEMBL12427908 | 0.78 | TYMP (0.44) | LMNATHRBCYP2C19TYMPCA12 | |
| SCHEMBL12264733 | 0.77 | EGFR (0.36) | EGFRDRD2DRD4DRD3CYP3A4 |
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-2011123444-A1 | APPLICATION OF STAUDINGER LIGATION IN PET IMAGING | SIEMENS MEDICAL SOLUTIONS USA, INC. (US) | 2011-10-06 | — | — | WO | disclosed |