Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 9/20 | 0.55 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.49 |
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22959029 | 1.00 | KCNH2 (0.55) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL22958983 | 0.91 | KCNH2 (0.56) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL22819395 | 0.86 | KCNH2 (0.39) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL29601605 | 0.86 | KCNH2 (0.39) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL21325598 | 0.83 | TLR8 (0.69) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL24719004 | 0.83 | TLR8 (0.69) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL22825664 | 0.78 | CA2 (0.36) | KCNH2TLR7TLR8 | |
| SCHEMBL28691699 | 0.77 | CYP2D6 (0.65) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL21325603 | 0.77 | CYP2D6 (0.65) | KCNH2TLR7TLR8CYP2D6 | |
| SCHEMBL13975896 | 0.77 | CYP2D6 (0.65) | KCNH2TLR7TLR8CYP2D6 |
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-4059924-A1 | 2,4-DIAMINOQUINAZOLINE DERIVATIVES AND MEDICAL USES THEREOF | Janssen Sciences Ireland Unlimited Company (IE) | 2022-09-21 | — | — | EP | disclosed |
| 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 |