Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 5/20 | 0.46 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.39 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28461486 | 0.93 | GPR119 (0.46) | GPR119USP30CHEK2CYP2C9HCAR1 | |
| SCHEMBL28450241 | 0.86 | USP30 (0.50) | GPR119USP30CHEK2HCAR1 | |
| SCHEMBL28463632 | 0.85 | FPR2 (0.48) | USP30CHEK2CYP2C9HCAR1HDAC4 | |
| SCHEMBL28457726 | 0.84 | PIK3CD (0.41) | USP30CHEK2HDAC4HDAC6PIK3CD | |
| SCHEMBL28449733 | 0.83 | CNR1 (0.46) | GPR119USP30CHEK2HDAC4HDAC6 | |
| SCHEMBL28898963 | 0.83 | HDAC1 (0.46) | GPR119USP30CHEK2HDAC4HDAC6 | |
| SCHEMBL28458581 | 0.83 | SRC (0.47) | GPR119USP30CHEK2HDAC4HDAC6 | |
| SCHEMBL28458448 | 0.82 | GPR119 (0.48) | GPR119USP30CHEK2CYP2C9HDAC4 | |
| SCHEMBL29968466 | 0.82 | GPR119 (0.48) | GPR119USP30CHEK2CYP2C9HDAC4 | |
| SCHEMBL28456031 | 0.82 | BTK (0.55) | — |
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-111662232-B | Small molecule compound with 2H-indazole structure and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-08-02 | — | — | CN | disclosed |
| CN-111662232-A | Small molecule compound with 2H-indazole structure and synthesis and application thereof | 中国科学院上海药物研究所 | 2020-09-15 | — | — | CN | disclosed |