Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER4 | P35408 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CTSC | P53634 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 2/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ACE | P12821 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19521207 | 0.89 | SLC6A3 (0.36) | PTGER4SLC6A3EPHX2NR3C2NPC1 | |
| SCHEMBL19521205 | 0.81 | CTSC (0.42) | CTSCF2CTSK | |
| SCHEMBL19521201 | 0.81 | CTSC (0.42) | CTSCF2CTSK | |
| SCHEMBL19544579 | 0.71 | CTSC (0.40) | CTSCCTSK | |
| SCHEMBL22582613 | 0.71 | CTSC (0.40) | CTSCCTSK | |
| SCHEMBL19544843 | 0.71 | CTSC (0.40) | CTSCCTSK | |
| SCHEMBL19544844 | 0.70 | YAP1 (0.39) | CTSCCTSSCTSK | |
| SCHEMBL19544840 | 0.70 | YAP1 (0.39) | CTSCCTSSCTSK | |
| SCHEMBL31536771 | 0.63 | CTSC (0.65) | CTSCCTSK | |
| SCHEMBL31593075 | 0.62 | POLB (0.41) | EPHX2MEN1KMT2AUSP2LMNA |
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 |