Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA | P35790 | 14/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL15212015 | 0.98 | CHKA (0.59) | CHKABCHEACHE | |
| Iodide SCHEMBL15212212 | 0.96 | CHKA (0.58) | CHKABCHEACHE | |
| Water SCHEMBL15212777 | 0.89 | CHKA (0.54) | CHKABCHEACHE | |
| SCHEMBL15211999 | 0.87 | CHKA (0.56) | CHKABCHEACHE | |
| Iodide SCHEMBL15212342 | 0.87 | CHKA (0.59) | CHKABCHEACHE | |
| Water SCHEMBL15211988 | 0.86 | CHKA (0.59) | CHKABCHEACHE | |
| Iodide SCHEMBL15212172 | 0.85 | CHKA (0.54) | CHKABCHEACHE | |
| SCHEMBL9328178 | 0.84 | CHKA (0.61) | CHKABCHEACHE | |
| Hydrochloric Acid SCHEMBL9328059 | 0.82 | CHKA (0.59) | CHKABCHEACHE | |
| SCHEMBL9329679 | 0.82 | CHKA (0.62) | CHKABCHEACHE |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9890050-B2 | Molecular sieve material, its synthesis and use | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2018-02-13 | — | — | US | disclosed |
| EP-2817262-B1 | MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE | EXXONMOBIL CHEMICAL PATENTS INC (US) | 2017-11-15 | — | — | EP | disclosed |
| US-20160368778-A1 | Molecular Sieve Material, Its Synthesis and Use | EXXONMOBIL CHEMICAL PATENTS INC. | 2016-12-22 | — | — | US | disclosed |
| US-9452423-B2 | Molecular sieve material, its synthesis and use | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2016-09-27 | — | — | US | disclosed |
| US-20150025291-A1 | Molecular Sieve Material, Its Synthesis and Use | EXXONMOBIL CHEMICAL PATENTS INC. | 2015-01-22 | — | — | US | disclosed |
| EP-2817262-A1 | MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE | ExxonMobil Chemical Patents Inc. (US) | 2014-12-31 | — | — | EP | disclosed |
| WO-2013126140-A1 | MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2013-08-29 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20150025291-A1 | Molecular Sieve Material, Its Synthesis and Use | RPS17, MMP17, MRPS27 | CHKA 4726/4885BCHE 4848/4885ACHE 4404/4885 |
| US-20160368778-A1 | Molecular Sieve Material, Its Synthesis and Use | MMP17, RPS17, CDK17 | CHKA 4718/4885BCHE 4850/4885ACHE 4357/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.