Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.41 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.40 |
| ▸ | JAK3 | P52333 | 2/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.40 |
| ▸ | CCR2 | P41597 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | TNIK | Q9UKE5 | 3/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26516659 | 1.00 | PIK3CA (0.41) | PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG | |
| SCHEMBL30360602 | 0.90 | JAK2 (0.41) | JAK2JAK3PTK2CCR2KDR | |
| SCHEMBL26516664 | 0.90 | JAK2 (0.41) | JAK2JAK3PTK2CCR2KDR | |
| SCHEMBL26516557 | 0.86 | MAP4K1 (0.47) | PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG | |
| SCHEMBL30360601 | 0.86 | MAP4K1 (0.47) | PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG | |
| SCHEMBL26516654 | 0.85 | CCR2 (0.41) | JAK2JAK3PTK2CCR2KDR | |
| SCHEMBL26119124 | 0.85 | CCR2 (0.47) | JAK2JAK3PTK2CCR2 | |
| SCHEMBL26119662 | 0.84 | OPRM1 (0.41) | JAK2JAK3PTK2CCR2KDR | |
| SCHEMBL26516660 | 0.84 | GPR119 (0.44) | JAK2JAK3PTK2PARP1PARP2 | |
| SCHEMBL29006626 | 0.80 | MAP4K1 (0.47) | JAK2JAK3PTK2PTGS2ACVR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115956077-A | Substituted heteroaryl compounds as TLR9 inhibitors | 百时美施贵宝公司 | 2023-04-11 | — | — | CN | claimed |