Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 16/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | USP2 | O75604 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27282238 | 1.00 | CYP2D6 (0.43) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL15222300 | 0.89 | CYP2D6 (0.49) | CYP2D6SMN1; SMN2CYP3A4CYP1A2ALDH1A1 | |
| SCHEMBL21870606 | 0.87 | CYP2D6 (0.37) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL27282158 | 0.87 | CYP2D6 (0.46) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL23075927 | 0.82 | CYP2D6 (0.56) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL12312347 | 0.80 | TSHR (0.47) | CYP2D6CYP1A2TSHRRORC | |
| SCHEMBL3422624 | 0.80 | CYP2D6 (0.53) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL23716384 | 0.80 | CYP2D6 (0.42) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL18212474 | 0.79 | CYP2D6 (0.52) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 | |
| SCHEMBL18926698 | 0.79 | CYP2D6 (0.56) | CYP2D6SMN1; SMN2CYP3A4CYP1A2USP2 |
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-2024081311-A1 | CBL-B MODULATORS AND USES THEREOF | NIMBUS CLIO, INC. (US) | 2024-04-18 | — | — | WO | disclosed |