Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 6/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21363222 | 0.91 | HDAC4 (0.47) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL6348724 | 0.91 | HDAC4 (0.52) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL6346073 | 0.89 | KMO (0.53) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL14433757 | 0.86 | OPRL1 (0.40) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL26806087 | 0.86 | HTR2C (0.62) | HTR2CSLC18A3SIGMAR1DRD2DRD3 | |
| SCHEMBL6935362 | 0.84 | HTR2C (0.52) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL20178631 | 0.82 | QDPR (0.53) | SIGMAR1DRD2DRD3 | |
| SCHEMBL18591297 | 0.82 | SLC6A2 (0.42) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL5666805 | 0.75 | KMO (0.62) | HTR2CHDAC4HDAC2HDAC8KMO | |
| SCHEMBL778529 | 0.74 | HDAC4 (0.63) | HTR2CHDAC4HDAC2HDAC8KMO |
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-3939962-A1 | METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2022-01-19 | — | — | EP | disclosed |