Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | PREP | P48147 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | SPR | P35270 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17925541 | 0.84 | HDAC1 (0.39) | ELANENR1H2HDAC1HSD11B1GPR119 | |
| SCHEMBL17925539 | 0.84 | HDAC1 (0.39) | ELANENR1H2HDAC1HSD11B1GPR119 | |
| SCHEMBL17936825 | 0.84 | HDAC1 (0.39) | ELANENR1H2HDAC1HSD11B1GPR119 | |
| SCHEMBL28361066 | 0.80 | HDAC1 (0.38) | ELANENR1H2NR1H3HDAC1RET | |
| SCHEMBL16700414 | 0.77 | NR1H2 (0.33) | NR1H2NR1H3GPR119 | |
| SCHEMBL16711396 | 0.76 | BTK (0.35) | NR1H2NR1H3HDAC1GPR119 | |
| SCHEMBL28883948 | 0.76 | NR1H2 (0.39) | NR1H2NR1H3HSD11B1GPR119MEN1 | |
| SCHEMBL28357473 | 0.75 | MEN1 (0.39) | NR1H2NR1H3GPR119MEN1KMT2A | |
| SCHEMBL16700086 | 0.73 | ADORA1 (0.36) | NR1H2NR1H3GPR119MEN1KMT2A | |
| SCHEMBL19860665 | 0.73 | ROCK2 (0.31) | HDAC1GPR119MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110804061-B | Pyrazole and pyrazine formamide compound containing cyclopropyl segment and application thereof | 中国医学科学院医药生物技术研究所 | 2021-01-05 | — | — | CN | disclosed |
| CN-110804061-A | Pyrazole and pyrazine formamide compound containing cyclopropyl segment and application thereof | 中国医学科学院医药生物技术研究所 | 2020-02-18 | — | — | CN | disclosed |