Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24921238 | 0.76 | BTK (0.42) | NPC1RAB9ASMN1; SMN2KDM4EMAPT | |
| SCHEMBL14447569 | 0.76 | SMN1; SMN2 (0.62) | CYP2C19NPC1RAB9ACYP1A2CYP2C9 | |
| SCHEMBL24921976 | 0.75 | SIRT6 (0.36) | — | |
| SCHEMBL24921972 | 0.75 | MAOB (0.35) | NPC1RAB9ASMN1; SMN2KDM4EMAPT | |
| SCHEMBL24920903 | 0.75 | CNR2 (0.40) | CYP2C19CYP1A1CYP1B1NPC1RAB9A | |
| SCHEMBL14031552 | 0.74 | CYP2C19 (0.37) | CYP2C19CYP1A1CYP1B1NPC1RAB9A | |
| SCHEMBL24921188 | 0.72 | S1PR1 (0.49) | MAPT | |
| SCHEMBL24921235 | 0.72 | CCR1 (0.61) | CYP2C19CYP1A1CYP1B1NPC1RAB9A | |
| SCHEMBL24920802 | 0.72 | LRRK2 (0.38) | — | |
| SCHEMBL24920840 | 0.72 | MAPT (0.45) | CYP2C19CYP1A1CYP1B1NPC1RAB9A |
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 |