Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19984569 | 0.96 | AAK1 (0.38) | ALDH1A1AAK1KDM4EGLAPOLB | |
| SCHEMBL19984699 | 0.85 | ALDH1A1 (0.47) | ALDH1A1AAK1KDM4EKMT2ASMN1; SMN2 | |
| SCHEMBL19984595 | 0.82 | ALDH1A1 (0.44) | ALDH1A1AAK1KDM4EMAPTKMT2A | |
| SCHEMBL19975006 | 0.72 | HCRTR1 (0.52) | ALDH1A1KDM4EPOLBSMN1; SMN2HCRTR1 | |
| SCHEMBL19975007 | 0.72 | HCRTR1 (0.52) | ALDH1A1KDM4EPOLBSMN1; SMN2HCRTR1 | |
| SCHEMBL9473812 | 0.70 | ALDH1A1 (0.48) | ALDH1A1POLBSMN1; SMN2ACE | |
| SCHEMBL3643939 | 0.70 | ALDH1A1 (0.48) | ALDH1A1POLBSMN1; SMN2ACE | |
| SCHEMBL7644709 | 0.69 | ALDH1A1 (0.47) | ALDH1A1POLBSMN1; SMN2ACE | |
| Acetamide SCHEMBL1358326 | 0.69 | ALDH1A1 (0.43) | ALDH1A1POLBSMN1; SMN2ACE | |
| Acetamide SCHEMBL1358328 | 0.69 | ALDH1A1 (0.43) | ALDH1A1POLBSMN1; SMN2ACE |
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-2018053157-A1 | HEPATITIS B CORE PROTEIN MODULATORS | ASSEMBLY BIOSCIENCES, INC. (US) | 2018-03-22 | — | — | WO | disclosed |