Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.32 |
| ▸ | NOS2 | P35228 | 3/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL29770643 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL20338348 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL28430002 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL29131780 | 0.81 | NOS3 (0.32) | NOS3NOS2NOS1 | |
| SCHEMBL28909733 | 0.78 | — | — | |
| Toluene SCHEMBL5419187 | 0.74 | TSHR (0.48) | TRPV1TDP1 | |
| SCHEMBL28537378 | 0.73 | — | — | |
| SCHEMBL12778096 | 0.71 | — | — | |
| Formamide SCHEMBL4091594 | 0.70 | NOS2 (0.50) | NOS3NOS2NOS1SIRT3TDP1 | |
| Formamide SCHEMBL7450809 | 0.70 | NOS3 (0.50) | NOS3NOS2NOS1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111225916-B | Novel compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders | 加拉帕戈斯股份有限公司 | 2023-11-03 | — | — | CN | claimed |
| CN-108349944-B | Indolin-2-one derivatives | 豪夫迈·罗氏有限公司 | 2021-03-30 | — | — | CN | claimed |
| CN-117534670-A | Novel compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders | 加拉帕戈斯股份有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-111225916-B | Novel compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders | 加拉帕戈斯股份有限公司 | 2023-11-03 | — | — | CN | disclosed |
| WO-2023134708-A1 | THIAZOLOPYRIDYL AMIDE DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | BEIGENE , LTD. (KY) | 2023-07-20 | — | — | WO | disclosed |
| CN-111892577-B | Compounds and methods for androgen receptor targeted degradation | 阿尔维纳斯运营股份有限公司 | 2023-07-07 | — | — | CN | disclosed |
| CN-108349944-B | Indolin-2-one derivatives | 豪夫迈·罗氏有限公司 | 2021-03-30 | — | — | CN | disclosed |
| CN-111892577-A | Compounds and methods for targeted degradation of androgen receptor | 阿尔维纳斯运营股份有限公司 | 2020-11-06 | — | — | CN | disclosed |
| CN-111225916-A | Novel compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders | 加拉帕戈斯股份有限公司 | 2020-06-02 | — | — | CN | disclosed |