Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YAP1 | P46937 | 1/20 | 0.39 |
| ▸ | CTSC | P53634 | 3/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.38 |
| ▸ | CTSS | P25774 | 5/20 | 0.38 |
| ▸ | CTSK | P43235 | 4/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | FPR1 | P21462 | 2/20 | 0.37 |
| ▸ | FPR2 | P25090 | 2/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | MC5R | P33032 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19544840 | 1.00 | YAP1 (0.39) | YAP1CTSCGPR119USP30MCL1 | |
| SCHEMBL19521205 | 0.88 | CTSC (0.42) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL19521201 | 0.88 | CTSC (0.42) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL19544579 | 0.85 | CTSC (0.40) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL22582613 | 0.85 | CTSC (0.40) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL19544843 | 0.85 | CTSC (0.40) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL30738936 | 0.83 | CTSC (0.56) | CTSCCTSK | |
| SCHEMBL30738860 | 0.76 | CTSC (0.49) | CTSCCTSK | |
| SCHEMBL9259835 | 0.75 | CTSS (0.63) | CTSSCTSK | |
| SCHEMBL9259839 | 0.75 | CTSS (0.63) | CTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017190048-A1 | COVALENT BTK INHIBITORS AND USES THEREOF | X-CHEM, INC. (US) | 2017-11-02 | — | — | WO | disclosed |