Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.51 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10094648 | 0.79 | DYRK1A (0.62) | DYRK1ACLK4GAAHPGDNISCH | |
| SCHEMBL28277835 | 0.77 | ADORA2A (0.46) | NOTUMGAANISCHKDM4EDPP4 | |
| SCHEMBL7944851 | 0.73 | DYRK1A (0.59) | DYRK1ACLK4GAANISCHMAPT | |
| SCHEMBL2576593 | 0.73 | DYRK1A (0.54) | DYRK1ACLK4NOTUMKMT2ANISCH | |
| SCHEMBL16806035 | 0.73 | DYRK1A (0.50) | DYRK1ACLK4GAATP53HPGD | |
| SCHEMBL29489425 | 0.72 | CYP3A4 (0.73) | DYRK1ACLK4NOTUMGAAKMT2A | |
| SCHEMBL196765 | 0.72 | CYP3A4 (0.73) | DYRK1ACLK4NOTUMGAAKMT2A | |
| SCHEMBL29133150 | 0.72 | S1PR1 (0.39) | HPGDMAPTALDH1A1MAOB | |
| SCHEMBL30622149 | 0.72 | S1PR1 (0.39) | HPGDMAPTALDH1A1MAOB | |
| SCHEMBL9380466 | 0.71 | DYRK1A (0.51) | DYRK1ACLK4NOTUMTP53MAPT |
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-109311902-A | Substituted imidazo [1,2-b] pyridazine, substituted imidazo [1,5-b] pyridazine, related compound and their purposes in treatment medical disorder | 溶酶体治疗股份有限公司 | 2019-02-05 | — | — | CN | disclosed |