Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21913758 | 1.00 | NR1H2 (0.49) | NR1H2HPGDDDB1CRBNUSP2 | |
| Hydrochloric Acid SCHEMBL29596834 | 0.98 | NR1H2 (0.47) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL15313304 | 0.87 | NR1H2 (0.53) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL16759817 | 0.85 | NR1H2 (0.58) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL18082348 | 0.85 | NR1H2 (0.58) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL23906938 | 0.84 | NR1H2 (0.51) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL16080285 | 0.83 | NR1H2 (0.50) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL18115862 | 0.83 | NR1H2 (0.50) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL18115864 | 0.83 | NR1H2 (0.50) | NR1H2HPGDDDB1CRBNUSP2 | |
| SCHEMBL400513 | 0.80 | NR1H2 (0.50) | NR1H2HPGDDDB1CRBNUSP2 |
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-114907338-A | Nitrogen-containing polycyclic fused ring compound, and pharmaceutical composition, preparation method and application thereof | 北京志健金瑞生物医药科技有限公司 | 2022-08-16 | — | — | CN | disclosed |