Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.34 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL24921169 | 0.77 | CCR1 (0.67) | CCR1CCR5CCR8CYP1A2CYP2D6 | |
| SCHEMBL24921978 | 0.72 | — | — | |
| SCHEMBL24920834 | 0.72 | CYP1A1 (0.35) | CCR1CCR5CCR8CYP1A2CYP2D6 | |
| SCHEMBL14031708 | 0.72 | PDPK1 (0.44) | PDPK1CCR1CCR5CCR8MAPK14 | |
| SCHEMBL24921542 | 0.72 | FTO (0.37) | MAP4K4 | |
| SCHEMBL14048365 | 0.71 | PDPK1 (0.40) | PDPK1CCR1CCR5CCR8MAPK14 | |
| SCHEMBL24921148 | 0.71 | BTK (0.46) | TGFBR1 | |
| SCHEMBL24920896 | 0.71 | CYP1A2 (0.31) | CYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL24920774 | 0.70 | PDPK1 (0.39) | PDPK1CCR1CCR5CCR8MAPK14 | |
| SCHEMBL24920898 | 0.70 | PDPK1 (0.39) | PDPK1CCR1CCR5CCR8MAPK14 |
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-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |