Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.40 |
| ▸ | BTK | Q06187 | 6/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.38 |
| ▸ | TNF | P01375 | 2/20 | 0.38 |
| ▸ | LITAF | Q99732 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL28456326 | 0.94 | APLNR (0.42) | APLNRPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL28460224 | 0.92 | CACNB4 (0.41) | PIK3CDPIK3CAPIK3CBPIK3CGALDH1A1 | |
| SCHEMBL28450201 | 0.90 | GPR119 (0.44) | FGFR3KDRALDH1A1LMNA | |
| SCHEMBL28452396 | 0.86 | BTK (0.53) | BTK | |
| SCHEMBL28457726 | 0.86 | PIK3CD (0.41) | PIK3CDPIK3CAPIK3CBPIK3CGBTK | |
| SCHEMBL28898962 | 0.85 | CACNB4 (0.41) | PIK3CDPIK3CAPIK3CBPIK3CGUSP30 | |
| SCHEMBL28452368 | 0.84 | IRAK4 (0.43) | ALDH1A1LMNA | |
| SCHEMBL28455471 | 0.83 | BTK (0.43) | APLNRPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL28898133 | 0.81 | APLNR (0.44) | APLNRPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL28898960 | 0.81 | GPR119 (0.46) | PIK3CDPIK3CAPIK3CBPIK3CGUSP30 |
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 |