Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 2/20 | 0.41 |
| ▸ | AKT2 | P31751 | 1/20 | 0.41 |
| ▸ | PDE2A | O00408 | 9/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
| ▸ | VNN1 | O95497 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL22685206 | 0.81 | PDE2A (0.48) | PDE2AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL19282962 | 0.80 | PDE2A (0.46) | AKT1PDE2AHDAC3HDAC1HDAC2 | |
| SCHEMBL22657408 | 0.79 | MALT1 (0.45) | AKT1PDE2AHDAC3HDAC1HDAC2 | |
| SCHEMBL22685207 | 0.79 | PDE2A (0.43) | PDE2AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL22657407 | 0.79 | CFTR (0.37) | AKT1AKT2CFTRCNR1BACE1 | |
| SCHEMBL17885232 | 0.77 | AKT1 (0.46) | AKT1AKT2KITCNR1CNR2 | |
| SCHEMBL22685182 | 0.77 | PDE2A (0.41) | PDE2AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL22686817 | 0.76 | PDE2A (0.46) | PDE2AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL28488029 | 0.75 | PTGS2 (0.35) | AKT1CFTRCNR1 | |
| SCHEMBL4087871 | 0.74 | AKT1 (0.43) | AKT1AKT2PDE2ACNR1CNR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112047877-A | Novel amide compound and use thereof | 和记黄埔医药（上海）有限公司 | 2020-12-08 | — | — | CN | disclosed |
| WO-2020228823-A1 | NOVEL AMIDE COMPOUNDS AND USES THEREOF | HUTCHISON MEDIPHARMA LIMITED (CN) | 2020-11-19 | — | — | WO | disclosed |