Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.50 |
| ▸ | JAK1 | P23458 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.49 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | PREP | P48147 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL43022 | 1.00 | JAK2 (0.50) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL39998 | 1.00 | JAK2 (0.50) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL27427012 | 0.94 | NR1H2 (0.52) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL30733147 | 0.91 | NR1H2 (0.55) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL30598863 | 0.89 | NR1H2 (0.60) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL20031433 | 0.89 | NR1H2 (0.60) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL20031051 | 0.89 | NR1H2 (0.60) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL20031049 | 0.89 | NR1H2 (0.60) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL6749254 | 0.89 | NR1H2 (0.60) | JAK2JAK1NR1H2GPR119CHRM2 | |
| SCHEMBL15061029 | 0.88 | GPR119 (0.56) | JAK2JAK1NR1H2GPR119HPGD |
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-113277991-B | Nitrogen heterocyclic ring amino derivative, preparation method thereof and anti-HIV-1 drug | 中国医学科学院医药生物技术研究所 | 2022-07-12 | — | — | CN | disclosed |