Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PEPD | P12955 | 1/20 | 0.34 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL19984595 | 0.97 | ALDH1A1 (0.44) | ALDH1A1AAK1HTTSMN1; SMN2CASP3 | |
| SCHEMBL19984522 | 0.85 | ALDH1A1 (0.38) | ALDH1A1AAK1SMN1; SMN2HCRTR1HCRTR2 | |
| SCHEMBL19984536 | 0.83 | ALDH1A1 (0.45) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL19984569 | 0.82 | AAK1 (0.38) | ALDH1A1AAK1HTTSMN1; SMN2KDM4E | |
| SCHEMBL28305430 | 0.74 | HCRTR1 (0.53) | ALDH1A1SMN1; SMN2HCRTR1HCRTR2CASP3 | |
| SCHEMBL19984545 | 0.74 | HCRTR1 (0.53) | ALDH1A1SMN1; SMN2HCRTR1HCRTR2CASP3 | |
| SCHEMBL7322642 | 0.72 | LTA4H (0.46) | ALDH1A1SMN1; SMN2CASP3SCN9AMEN1 | |
| SCHEMBL19975403 | 0.71 | HCRTR1 (0.50) | ALDH1A1HCRTR1HCRTR2CASP3GAA | |
| SCHEMBL20108320 | 0.68 | CASP3 (0.41) | ALDH1A1HCRTR1HCRTR2CASP3FPR2 | |
| SCHEMBL23119683 | 0.67 | MAPT (0.53) | ALDH1A1HTTSMN1; SMN2KDM4EMEN1 |
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 |