Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 10/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | FPR1 | P21462 | 4/20 | 0.38 |
| ▸ | FPR2 | P25090 | 4/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19544579 | 1.00 | CTSC (0.40) | CTSCKCNH2CTSKFPR1FPR2 | |
| SCHEMBL22582613 | 1.00 | CTSC (0.40) | CTSCKCNH2CTSKFPR1FPR2 | |
| SCHEMBL19521201 | 0.89 | CTSC (0.42) | CTSCKCNH2CTSKFPR1FPR2 | |
| SCHEMBL19521205 | 0.89 | CTSC (0.42) | CTSCKCNH2CTSKFPR1FPR2 | |
| SCHEMBL19544840 | 0.85 | YAP1 (0.39) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL19544844 | 0.85 | YAP1 (0.39) | CTSCCTSKFPR1FPR2 | |
| SCHEMBL19521207 | 0.83 | SLC6A3 (0.36) | CTSCKCNH2CTSKHSD11B1 | |
| SCHEMBL19544833 | 0.75 | CHRM3 (0.38) | CTSCFPR1FPR2CHRM3DPP4 | |
| SCHEMBL19544841 | 0.75 | CTSC (0.69) | CTSCKCNH2CTSKFPR1FPR2 | |
| SCHEMBL19544837 | 0.73 | PIN1 (0.38) | FPR1FPR2CHRM3 |
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 |