Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 9/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20998606 | 0.90 | TDP1 (0.39) | BTKABL1CHRM1HRH3 | |
| SCHEMBL16670716 | 0.87 | KCNH2 (0.41) | BTKPARP10PARP14KCNH2SCN3A | |
| SCHEMBL16671067 | 0.87 | BTK (0.51) | BTKPARP10PARP14 | |
| SCHEMBL16670558 | 0.85 | BTK (0.41) | BTKPARP10PARP14KCNH2SCN3A | |
| SCHEMBL16670556 | 0.85 | BTK (0.41) | BTKPARP10PARP14KCNH2SCN3A | |
| SCHEMBL16670236 | 0.84 | BTK (0.42) | BTKPARP10PARP14ABL1USP2 | |
| SCHEMBL16676752 | 0.83 | PARP10 (0.48) | BTKPARP10PARP14KCNH2SCN3A | |
| SCHEMBL16670985 | 0.82 | BTK (0.43) | BTKPARP10PARP14KCNH2SCN3A | |
| SCHEMBL16671257 | 0.81 | PARP10 (0.46) | BTKPARP10PARP14KCNH2SCN3A | |
| SCHEMBL20998624 | 0.81 | TDP1 (0.46) | SYK |
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 |
|---|---|---|---|---|---|---|---|
| EP-3060550-B1 | HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2019-05-15 | — | — | EP | disclosed |