Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Chlorthalidone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.98 |
| ▸ | CA2 | P00918 | 8/20 | 0.98 |
| ▸ | CA7 | P43166 | 3/20 | 0.98 |
| ▸ | CA12 | O43570 | 2/20 | 0.98 |
| ▸ | CA3 | P07451 | 2/20 | 0.98 |
| ▸ | MAPT | P10636 | 2/20 | 0.98 |
| ▸ | CA4 | P22748 | 2/20 | 0.98 |
| ▸ | CA6 | P23280 | 2/20 | 0.98 |
| ▸ | CA5A | P35218 | 2/20 | 0.98 |
| ▸ | CA9 | Q16790 | 2/20 | 0.98 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.98 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.98 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | MMP2 | P08253 | 3/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Chlorthalidone SCHEMBL26234 | 0.99 | CA1 (1.00) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL4425734 | 0.99 | CA1 (1.00) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL29687442 | 0.99 | CA1 (1.00) | CA1CA2CA7CA12CA3 | |
| (R)-Chlorthalidone SCHEMBL30872862 | 0.99 | CA1 (1.00) | CA1CA2CA7CA12CA3 | |
| (R)-Chlorthalidone SCHEMBL827454 | 0.99 | CA1 (1.00) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL164949 | 0.99 | CA1 (1.00) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL7305527 | 0.94 | CA1 (0.91) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL29127388 | 0.90 | CA1 (0.84) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL28297372 | 0.84 | CA1 (0.73) | CA1CA2CA7CA12CA3 | |
| Chlorthalidone SCHEMBL4984545 | 0.84 | CA1 (0.73) | CA1CA2CA7CA12CA3 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118221656-A | Compounds useful for the treatment of gastrointestinal disorders | 阿德利克斯股份有限公司 | 2024-06-21 | — | — | CN | disclosed |
| CN-116942648-A | Liquid preparation of esketamine and application thereof | 宜昌人福药业有限责任公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-116942647-A | Liquid preparation of esketamine and application thereof | 宜昌人福药业有限责任公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-115282221-A | Traditional Chinese medicine composition for treating idiopathic pulmonary fibrosis and application thereof | 上海中医药大学附属曙光医院 | 2022-11-04 | — | — | CN | disclosed |
| CN-114159533-B | Traditional Chinese medicine composition for treating multiple drug-resistant bacterial infection and application thereof | 上海中医药大学附属龙华医院 | 2022-10-21 | — | — | CN | disclosed |
| CN-114159533-A | Traditional Chinese medicine composition for treating multiple drug-resistant bacterial infection and application thereof | 上海中医药大学附属龙华医院 | 2022-03-11 | — | — | CN | disclosed |
| CN-113861268-A | Cell penetrating peptides and methods of making and using the same | 恩特拉达治疗学股份有限公司 | 2021-12-31 | — | — | CN | disclosed |
| CN-107348521-B | Traditional Chinese medicine composite peptide composition with gastrointestinal tract improving function and preparation method thereof | 宁波御坊堂生物科技有限公司 | 2021-02-09 | — | — | CN | disclosed |