Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 10/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | FGR | P09769 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30104436 | 1.00 | BTK (0.35) | BTKLRRK2CYP11B1CYP11B2AURKA | |
| Hydrochloric Acid SCHEMBL30104403 | 0.90 | BTK (0.36) | BTKCYP11B1CYP11B2AURKAFGR | |
| SCHEMBL21791537 | 0.89 | BTK (0.37) | BTKCYP11B1CYP11B2AURKAFGR | |
| Hydrochloric Acid SCHEMBL30104473 | 0.87 | BTK (0.36) | BTKCYP11B1CYP11B2AURKAFGR | |
| Hydrochloric Acid SCHEMBL30104502 | 0.87 | BTK (0.35) | BTKCYP11B1CYP11B2AURKAFGR | |
| SCHEMBL21791285 | 0.86 | LRRK2 (0.36) | LRRK2CYP11B1CYP11B2KCNH2 | |
| Hydrochloric Acid SCHEMBL30104398 | 0.83 | BTK (0.39) | BTKAURKAFGRCYP2C9SRC | |
| Hydrochloric Acid SCHEMBL28587621 | 0.83 | BTK (0.41) | BTKAURKAFGRCYP2C9SRC | |
| Hydrochloric Acid SCHEMBL30104448 | 0.83 | BTK (0.41) | BTKAURKAFGRCYP2C9SRC | |
| SCHEMBL21791515 | 0.82 | BTK (0.41) | BTKAURKAFGRCYP2C9SRC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3843847-A1 | FUSED IMIDAZOPYRIDINES AS REVERSIBLE INHIBITORS OF BRUTON'S TYROSINE KINASE (BTK) | Merck Patent GmbH (DE) | 2021-07-07 | — | — | EP | claimed |
| WO-2020043638-A1 | FUSED IMIDAZOPYRIDINES AS REVERSIBLE INHIBITORS OF BRUTON'S TYROSINE KINASE (BTK) | MERCK PATENT GMBH (DE) | 2020-03-05 | — | — | WO | claimed |