Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.59 |
| ▸ | EGFR | P00533 | 2/20 | 0.58 |
| ▸ | SYK | P43405 | 2/20 | 0.56 |
| ▸ | CDK9 | P50750 | 4/20 | 0.56 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.56 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.56 |
| ▸ | CDK2 | P24941 | 3/20 | 0.56 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.54 |
| ▸ | WEE1 | P30291 | 4/20 | 0.54 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.54 |
| ▸ | PTK2 | Q05397 | 3/20 | 0.54 |
| ▸ | FLT3 | P36888 | 2/20 | 0.53 |
| ▸ | BTK | Q06187 | 2/20 | 0.53 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.51 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.51 |
| ▸ | JAK2 | O60674 | 1/20 | 0.51 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29463622 | 1.00 | BRD4 (0.59) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL28709832 | 0.93 | FLT3 (0.60) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL28876195 | 0.91 | BRD4 (0.65) | BRD4EGFRSYKCDK9CDK2 | |
| SCHEMBL29463627 | 0.91 | BRD4 (0.65) | BRD4EGFRSYKCDK9CDK2 | |
| SCHEMBL29463626 | 0.91 | BRD4 (0.72) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL28876170 | 0.91 | BRD4 (0.72) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL29389923 | 0.90 | EGFR (0.58) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL28691617 | 0.90 | EGFR (0.58) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL29463618 | 0.89 | BRD4 (0.59) | BRD4EGFRSYKCDK9CCNT1 | |
| SCHEMBL28876151 | 0.89 | BRD4 (0.59) | BRD4EGFRSYKCDK9CCNT1 |
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-114230524-A | (5-fluoro-2-anilinopyrimidin-4-yl) amino-N-hydroxybenzamide derivative and preparation method and application thereof | 南通大学 | 2022-03-25 | — | — | CN | claimed |
| CN-114230524-A | (5-fluoro-2-anilinopyrimidin-4-yl) amino-N-hydroxybenzamide derivative and preparation method and application thereof | 南通大学 | 2022-03-25 | — | — | CN | disclosed |