Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 10/20 | 0.52 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 2/20 | 0.42 |
| ▸ | BCR | P11274 | 2/20 | 0.42 |
| ▸ | TEK | Q02763 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL29911864 | 0.99 | IRAK4 (0.53) | IRAK4CNR2PIM1PIM3PIM2 | |
| SCHEMBL29911955 | 0.91 | IRAK4 (0.51) | IRAK4ABL1BCR | |
| SCHEMBL28976254 | 0.84 | IRAK4 (0.51) | IRAK4PIM3PIM2ABL1BCR | |
| SCHEMBL28976179 | 0.83 | IRAK4 (0.52) | IRAK4PIM3PIM2ABL1BCR | |
| SCHEMBL29911712 | 0.81 | IRAK4 (0.56) | IRAK4PIM1PIM3PIM2ABL1 | |
| SCHEMBL29911867 | 0.80 | IRAK4 (0.58) | IRAK4ABL1BCRLMNA | |
| SCHEMBL29911657 | 0.80 | IRAK4 (0.49) | IRAK4PIM1PIM3ABL1BCR | |
| Hydrochloric Acid SCHEMBL29911751 | 0.80 | IRAK4 (0.49) | IRAK4PIM1PIM3ABL1BCR | |
| SCHEMBL29911608 | 0.78 | IRAK4 (0.47) | IRAK4TEK | |
| Hydrochloric Acid SCHEMBL29911699 | 0.78 | IRAK4 (0.47) | IRAK4TEK |
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-115531387-A | Pyrazole amide compounds useful as IRAK inhibitors | 里格尔药品股份有限公司 | 2022-12-30 | — | — | CN | disclosed |
| CN-110234637-B | Pyrazole amide compounds useful as IRAK inhibitors | 里格尔药品股份有限公司 | 2022-11-01 | — | — | CN | disclosed |