Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.43 |
| ▸ | BCAT2 | O15382 | 2/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | SYK | P43405 | 2/20 | 0.40 |
| ▸ | IDH2 | P48735 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 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 | |
|---|---|---|---|---|
| SCHEMBL29800136 | 0.85 | IKBKB (0.44) | IKBKBPDE4BPTGS1PTGS2LMNA | |
| SCHEMBL945449 | 0.80 | HSP90AA1 (0.52) | PTGS1PTGS2 | |
| SCHEMBL30627185 | 0.80 | F2 (0.42) | IKBKBIDH2PTGS1PTGS2KDM4E | |
| SCHEMBL59061 | 0.78 | JAK2 (0.41) | JAK2BCAT2SYKIDH2PTGS1 | |
| SCHEMBL27896613 | 0.77 | MAP2K3 (0.51) | MAP2K3BCAT2IKBKBKDM4EHSD17B10 | |
| SCHEMBL31374321 | 0.77 | PDE4B (0.38) | PDE4BSYKADORA2APDE11APDE10A | |
| SCHEMBL27651135 | 0.76 | MAP2K3 (0.46) | MAP2K3BCAT2IKBKBKDM4EHSD17B10 | |
| SCHEMBL4504523 | 0.75 | JAK2 (0.49) | JAK2BCAT2KDM4EHSD17B10LMNA | |
| SCHEMBL2159117 | 0.75 | MAP2K3 (0.49) | JAK2MAP2K3IKBKBPDE4BSYK | |
| SCHEMBL30627079 | 0.74 | TRPA1 (0.53) | — |
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-116348115-A | Combination of antibody-drug conjugate and PARP1 selective inhibitor | 阿斯利康(英国)有限公司 | 2023-06-27 | — | — | CN | disclosed |