Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | CTSC | P53634 | 4/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19521180 | 0.89 | PTGER4 (0.39) | SLC6A3PTGER4EPHX2CTSCNPC1 | |
| SCHEMBL19544843 | 0.83 | CTSC (0.40) | CTSCHSD11B1CTSKKCNH2 | |
| SCHEMBL19544579 | 0.83 | CTSC (0.40) | CTSCHSD11B1CTSKKCNH2 | |
| SCHEMBL22582613 | 0.83 | CTSC (0.40) | CTSCHSD11B1CTSKKCNH2 | |
| SCHEMBL19521201 | 0.71 | CTSC (0.42) | CTSCCTSKKCNH2F2 | |
| SCHEMBL19521205 | 0.71 | CTSC (0.42) | CTSCCTSKKCNH2F2 | |
| SCHEMBL19544840 | 0.68 | YAP1 (0.39) | CTSCCTSKCTSS | |
| SCHEMBL19544844 | 0.68 | YAP1 (0.39) | CTSCCTSKCTSS | |
| SCHEMBL31536771 | 0.61 | CTSC (0.65) | CTSCCTSKKCNH2 | |
| SCHEMBL19544833 | 0.59 | CHRM3 (0.38) | CTSC |
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 |