Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 8/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.53 |
| ▸ | FLT1 | P17948 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | DDT | P30046 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL1230837 | 0.79 | FLT3 (0.64) | PTGS2CA12CA9FLT3GSK3B | |
| SCHEMBL28408571 | 0.78 | KDR (0.69) | NOTUMFLT1KDRPRSS12CA12 | |
| SCHEMBL28408386 | 0.78 | FLT3 (0.69) | NOTUMFLT1KDRPTGS2CA12 | |
| SCHEMBL29657637 | 0.78 | FLT3 (0.69) | NOTUMFLT1KDRPTGS2CA12 | |
| SCHEMBL28416367 | 0.76 | PTGS2 (0.63) | KDRPTGS2CA12CA9FLT3 | |
| SCHEMBL28418357 | 0.74 | STS (0.62) | NOTUMKDRPTGS2CA12CA9 | |
| SCHEMBL29657629 | 0.74 | STS (0.62) | NOTUMKDRPTGS2CA12CA9 | |
| SCHEMBL17115582 | 0.74 | KIF11 (0.63) | NOTUMKDR | |
| SCHEMBL30861660 | 0.74 | KIF11 (0.63) | NOTUMKDR | |
| SCHEMBL28418132 | 0.73 | PTGS2 (0.64) | KDRPTGS2CA12CA9FLT3 |
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-111153889-B | 2-indolone-triazole anti-tumor compound and preparation method and application thereof | 中国医科大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-111153889-A | 2-indolone-triazole anti-tumor compound and preparation method and application thereof | 中国医科大学 | 2020-05-15 | — | — | CN | disclosed |