Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Polythiazide. 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 | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.57 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Polythiazide SCHEMBL27909 | 0.91 | CHRM1 (0.69) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| Polythiazide SCHEMBL29360913 | 0.91 | CHRM1 (0.69) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| Polythiazide SCHEMBL27910 | 0.91 | CHRM1 (0.69) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| Polythiazide SCHEMBL7254498 | 0.90 | CHRM1 (0.67) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| Polythiazide SCHEMBL6929926 | 0.87 | CHRM1 (0.76) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| Polythiazide SCHEMBL28142140 | 0.81 | LMNA (0.61) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| SCHEMBL17471591 | 0.80 | CHRM1 (0.53) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| SCHEMBL20369197 | 0.78 | CHRM1 (0.50) | CHRM1ADRA1ALMNACYP3A4CA1 | |
| SCHEMBL19166900 | 0.77 | CHRM1 (0.47) | CHRM1ADRA1A | |
| Methalthiazide SCHEMBL29691455 | 0.76 | CHRM1 (0.69) | CHRM1ADRA1ALMNACYP3A4CA1 |
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-103717597-B | Heterocyclic compounds as kinase inhibitors | 原真股份有限公司 | 2017-07-04 | — | — | CN | disclosed |
| CN-103492389-B | Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases | 原真股份有限公司 | 2016-09-14 | — | — | CN | disclosed |