Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 2/20 | 0.38 |
| ▸ | ALB | P02768 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL6954472 | 0.79 | TTR (0.44) | TTRALBALDH1A1CYP2A6LOXL2 | |
| Hydrochloric Acid SCHEMBL2356397 | 0.77 | ALDH1A1 (0.39) | TTRALBALDH1A1CYP2A6MEN1 | |
| SCHEMBL28384865 | 0.76 | TTR (0.38) | TTRALBALDH1A1CYP2A6LOXL2 | |
| SCHEMBL2890437 | 0.76 | RAPGEF4 (0.33) | RAPGEF4HDAC8 | |
| SCHEMBL1484862 | 0.75 | MAOA (0.46) | TTRALBALDH1A1CYP2A6MEN1 | |
| SCHEMBL19354876 | 0.74 | TTR (0.37) | TTRALBALDH1A1CYP2A6LOXL2 | |
| SCHEMBL10429296 | 0.74 | TTR (0.37) | TTRALBLOXL2KCNH2GPR35 | |
| SCHEMBL10429291 | 0.74 | TTR (0.52) | TTRALBALDH1A1CYP2A6LOXL2 | |
| SCHEMBL2153449 | 0.74 | TTR (0.44) | TTRALBALDH1A1CYP2A6MEN1 | |
| SCHEMBL2154905 | 0.73 | TTR (0.39) | TTRALBALDH1A1CYP2A6LOXL2 |
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-2022095904-A1 | PYRAZOLOPYRIDAZINONE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | 北京伯汇生物技术有限公司 | 2022-05-12 | — | — | WO | disclosed |