Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28492460 | 1.00 | KDM4E (0.44) | KDM4EGAAALDH1A1BACE2MAPKAPK2 | |
| SCHEMBL27252256 | 0.83 | KDM4E (0.44) | KDM4EGAAALDH1A1BACE2MAPKAPK2 | |
| SCHEMBL28073095 | 0.81 | GAA (0.54) | KDM4EGAAALDH1A1BACE2MAPKAPK2 | |
| SCHEMBL29642840 | 0.78 | GAA (0.48) | KDM4EGAAALDH1A1BACE2CSNK1A1 | |
| SCHEMBL17940771 | 0.78 | GAA (0.48) | KDM4EGAAALDH1A1BACE2CSNK1A1 | |
| SCHEMBL21463469 | 0.78 | MERTK (0.51) | ALDH1A1LRRK2MEN1LMNAMAPT | |
| SCHEMBL30615492 | 0.78 | MERTK (0.51) | ALDH1A1LRRK2MEN1LMNAMAPT | |
| SCHEMBL28072955 | 0.78 | GAA (0.50) | KDM4EGAAALDH1A1BACE2MAPKAPK2 | |
| SCHEMBL17940699 | 0.74 | IDO1 (0.56) | KDM4EGAAALDH1A1MEN1LMNA | |
| SCHEMBL29642825 | 0.74 | IDO1 (0.56) | KDM4EGAAALDH1A1MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-111868037-B | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2023-10-13 | — | — | CN | disclosed |