Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 6/20 | 0.52 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.52 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.52 |
| ▸ | QDPR | P09417 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 6/20 | 0.46 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 4/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15689645 | 0.87 | RECQL (0.41) | TLR9TLR8TLR7 | |
| SCHEMBL20757499 | 0.81 | CHRNB2 (0.41) | TLR9TLR8TLR7HTR3A | |
| SCHEMBL5584524 | 0.79 | TLR7 (0.56) | TLR9TLR8TLR7QDPRHTR2C | |
| SCHEMBL31510721 | 0.79 | QDPR (0.56) | TLR9TLR8TLR7QDPRHTR2C | |
| SCHEMBL15535152 | 0.79 | MKNK1 (0.55) | TLR9TLR8TLR7QDPRHTR2C | |
| SCHEMBL12975529 | 0.79 | QDPR (0.47) | TLR9TLR8TLR7QDPRHTR2C | |
| Hydrochloric Acid SCHEMBL21381982 | 0.77 | TLR9 (0.51) | TLR9TLR8TLR7QDPRHTR2C | |
| Hydrochloric Acid SCHEMBL30567977 | 0.77 | TLR9 (0.51) | TLR9TLR8TLR7QDPRHTR2C | |
| Hydrochloric Acid SCHEMBL1550605 | 0.77 | HTR2C (0.56) | TLR9TLR8TLR7QDPRHTR2C | |
| SCHEMBL15602523 | 0.77 | SLC18A3 (0.47) | TLR9TLR8TLR7QDPRHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| CN-105431420-B | Diheteroaryl compounds and uses thereof | 豪夫迈·罗氏有限公司 | 2019-08-13 | — | — | CN | disclosed |
| CN-110003178-A | Two heteroaryl compounds and application thereof | 豪夫迈·罗氏有限公司 | 2019-07-12 | — | — | CN | disclosed |