Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.50 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.37 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.37 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.37 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.37 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.37 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.37 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL22825595 | 0.87 | KCNH2 (0.55) | KCNH2TLR8TLR7CSNK1A1CSNK1D | |
| SCHEMBL21325597 | 0.87 | KCNH2 (0.43) | KCNH2TLR8TLR7HSP90AB1CSNK1A1 | |
| SCHEMBL24384583 | 0.86 | KCNH2 (0.44) | KCNH2TLR8TLR7CSNK1A1CSNK1D | |
| SCHEMBL22825820 | 0.85 | KCNH2 (0.44) | KCNH2TLR8TLR7HSP90AB1CYP2D6 | |
| SCHEMBL22825828 | 0.84 | KCNH2 (0.41) | KCNH2TLR8TLR7 | |
| SCHEMBL22825984 | 0.83 | KCNH2 (0.41) | KCNH2TLR8TLR7CSNK1A1CSNK1D | |
| SCHEMBL21325636 | 0.81 | CYP2C9 (0.58) | KCNH2TLR8TLR7CSNK1A1CSNK1D | |
| SCHEMBL24384690 | 0.81 | KCNH2 (0.52) | KCNH2TLR8TLR7HSP90AB1CYP2D6 | |
| SCHEMBL24384556 | 0.81 | KCNH2 (0.39) | KCNH2TLR8TLR7CYP2D6 | |
| SCHEMBL22825458 | 0.81 | KCNH2 (0.52) | KCNH2TLR8TLR7HSP90AB1CYP2D6 |
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-3759083-B1 | 2,4-DIAMINOQUINAZOLINE DERIVATIVES AND USE THEREOF IN THE TREATMENT OF VIRUS INFECTIONS, CANCER OR ALLERGIES | JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) | 2022-05-04 | — | — | EP | disclosed |