Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 16/20 | 0.72 |
| ▸ | LCK | P06239 | 7/20 | 0.72 |
| ▸ | SRC | P12931 | 5/20 | 0.72 |
| ▸ | TEK | Q02763 | 3/20 | 0.72 |
| ▸ | KDR | P35968 | 2/20 | 0.72 |
| ▸ | LYN | P07948 | 2/20 | 0.65 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.63 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.63 |
| ▸ | EGFR | P00533 | 5/20 | 0.57 |
| ▸ | ITK | Q08881 | 3/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.55 |
| ▸ | ABL1 | P00519 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
| ▸ | YES1 | P07947 | 1/20 | 0.55 |
| ▸ | HCK | P08631 | 1/20 | 0.55 |
| ▸ | FGR | P09769 | 1/20 | 0.55 |
| ▸ | FER | P16591 | 1/20 | 0.55 |
| ▸ | CSK | P41240 | 1/20 | 0.55 |
| ▸ | TEC | P42680 | 1/20 | 0.55 |
| ▸ | BLK | P51451 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL31649510 | 1.00 | BTK (0.72) | BTKLCKSRCTEKKDR | |
| SCHEMBL31649915 | 0.95 | BTK (0.70) | BTKLCKSRCTEKKDR | |
| SCHEMBL24196555 | 0.95 | BTK (0.67) | BTKLCKSRCTEKKDR | |
| Trifluoroacetic Acid SCHEMBL28702677 | 0.94 | BTK (0.64) | BTKLCKSRCTEKKDR | |
| SCHEMBL28691557 | 0.94 | BTK (0.69) | BTKLCKSRCTEKKDR | |
| SCHEMBL22720709 | 0.93 | BTK (0.70) | BTKLCKSRCTEKKDR | |
| SCHEMBL22720825 | 0.93 | BTK (0.66) | BTKLCKSRCTEKKDR | |
| SCHEMBL25075054 | 0.93 | BTK (0.69) | BTKLCKSRCTEKKDR | |
| SCHEMBL24196915 | 0.91 | BTK (0.65) | BTKLCKSRCTEKKDR | |
| SCHEMBL30144656 | 0.91 | BTK (0.64) | BTKLCKSRCTEKKDR |
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-113999233-A | BTK inhibitor ring derivative, preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2022-02-01 | — | — | CN | disclosed |