Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 7/20 | 0.62 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.60 |
| ▸ | LATS1 | O95835 | 3/20 | 0.58 |
| ▸ | LATS2 | Q9NRM7 | 3/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | DRD1 | P21728 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL25201997 | 0.93 | TLR8 (0.73) | TLR8TLR7KCNH2LATS1LATS2 | |
| SCHEMBL25184752 | 0.92 | TLR8 (0.68) | TLR8TLR7KCNH2LATS1LATS2 | |
| SCHEMBL13975545 | 0.81 | KCNH2 (0.84) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL19722979 | 0.81 | KCNH2 (0.84) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL13975094 | 0.80 | KCNH2 (0.65) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL13975833 | 0.80 | KCNH2 (0.65) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL13975710 | 0.80 | KCNH2 (0.85) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL19723066 | 0.80 | KCNH2 (0.85) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL13975544 | 0.78 | KCNH2 (0.84) | TLR8TLR7KCNH2CYP2D6DRD1 | |
| SCHEMBL30376965 | 0.78 | TLR8 (0.50) | TLR8TLR7KCNH2LATS1LATS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116472047-A | Arylamine derivative, preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2023-07-21 | — | — | CN | disclosed |
| WO-2023078241-A1 | AROMATIC AMINE DERIVATIVES AND PREPARATION METHOD AND MEDICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2023-05-11 | — | — | WO | disclosed |
| WO-2023078241-A1 | AROMATIC AMINE DERIVATIVES AND PREPARATION METHOD AND MEDICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2023-05-11 | — | — | WO | disclosed |