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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 5/20 | 0.94 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.72 |
| ▸ | TP53 | P04637 | 1/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.72 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.72 |
| ▸ | TSHR | P16473 | 1/20 | 0.72 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.72 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.72 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.71 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | APAF1 | O14727 | 1/20 | 0.55 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.55 |
| ▸ | RAD52 | P43351 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL3485786 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL5427605 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL5419812 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL3485493 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL875759 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL5427521 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL11137195 | 1.00 | DNM1 (0.94) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| SCHEMBL332945 | 0.97 | DNM1 (1.00) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| SCHEMBL640740 | 0.97 | DNM1 (1.00) | DNM1SLC22A1ALDH1A1TP53CYP3A4 | |
| SCHEMBL332106 | 0.97 | DNM1 (1.00) | DNM1SLC22A1ALDH1A1TP53CYP3A4 |
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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109678871-B | Method for preparing bisbenzylisoquinoline compounds | 山东师范大学 | 2020-09-29 | — | — | CN | claimed |
| CN-103818896-A | Method for asymmetrically modifying grapheme or oxidized grapheme | UNIV TAIYUAN TECHNOLOGY | 2014-05-28 | — | — | CN | claimed |
| CN-103641098-A | Method of quickly assembling nano carbon material to oil-water interface to form flexible membrane | UNIV TAIYUAN TECHNOLOGY | 2014-03-19 | — | — | CN | claimed |
| US-20110124734-A1 | N-HALOGENATED AMINO ACID FORMULATIONS AND METHODS FOR CLEANING AND DISINFECTION | ALCON RESEARCH, LTD. (US) | 2011-05-26 | — | — | US | claimed |
| JP-2010525886-A | — | — | 2010-07-29 | — | — | JP | claimed |
| EP-2139518-A1 | N-HALOGENATED AMINO ACID FORMULATIONS | Alcon Research, Ltd. (US) | 2010-01-06 | — | — | EP | claimed |
| EP-2139521-A1 | N-HALOGENATED AMINO ACID FORMULATIONS AND METHODS FOR CLEANING AND DISINFECTION | Alcon Research, Ltd. (US) | 2010-01-06 | — | — | EP | claimed |
| WO-2008134694-A1 | N-HALOGENATED AMINO ACID FORMULATIONS AND METHODS FOR CLEANING AND DISINFECTION | ALCON RESEARCH, LTD. (US) | 2008-11-06 | — | — | WO | claimed |
| WO-2008134687-A1 | N-HALOGENATED AMINO ACID FORMULATIONS | ALCON RESEARCH, LTD. (US) | 2008-11-06 | — | — | WO | claimed |
| US-20080275123-A1 | N-HALOGENATED AMINO ACID FORMULATIONS | ALCON RESEARCH, LTD. (US) | 2008-11-06 | — | — | US | claimed |
| US-20080275121-A1 | N-HALOGENATED AMINO ACID FORMULATIONS AND METHODS FOR CLEANING AND DISINFECTION | ALCON RESEARCH, LTD. (US) | 2008-11-06 | — | — | US | claimed |
| US-20070135651-A1 | Polymer-stabilised, crystallised, catanionic membranes, preparation method thereof and applications of same | COMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2007-06-14 | — | — | US | claimed |
| US-4744834-A | Photoresist stripper comprising a pyrrolidinone, a diethylene glycol ether, a polyglycol and a quaternary ammonium hydroxide | VERSUM MATERIALS US, LLC | 1988-05-17 | — | — | US | claimed |
| US-4411981-A | EXPOSURE TO ACTINIC RADIATION, DEVELOPMENT, AND ETCHING | SHARP KABUSHIKI KAISHA (JP) | 1983-10-25 | — | — | US | claimed |
| CN-118479493-A | Synthesis method of micro-mesoporous composite aluminum phosphate molecular sieve | 郑州大学 | 2024-08-13 | — | — | CN | disclosed |
| CN-109678871-B | Method for preparing bisbenzylisoquinoline compounds | 山东师范大学 | 2020-09-29 | — | — | CN | disclosed |
| CN-107840347-B | Titanium-silicon molecular sieve and preparation method and application thereof | 中国石油化工股份有限公司 | 2020-08-18 | — | — | CN | disclosed |
| US-4411735-A | Polymeric insulation layer etching process and composition | NATIONAL SEMICONDUCTOR CORPORATION (US) | 1983-10-25 | — | — | US | disclosed |
| US-4411981-A | EXPOSURE TO ACTINIC RADIATION, DEVELOPMENT, AND ETCHING | SHARP KABUSHIKI KAISHA (JP) | 1983-10-25 | — | — | US | disclosed |
| US-4370170-A | IONIZING SALT, BLENDING | PHILLIPS PETROLEUM CO. (US) | 1983-01-25 | — | — | US | 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 (4 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-20080275121-A1 | N-HALOGENATED AMINO ACID FORMULATIONS AND METHODS FOR CLEANING AND DISINFECTION | BCAT1, BCAT2, ASNS | DNM1 1650/4885SLC22A1 2599/4885ALDH1A1 2331/4885 |
| US-20110124734-A1 | N-HALOGENATED AMINO ACID FORMULATIONS AND METHODS FOR CLEANING AND DISINFECTION | BCAT1, BCAT2, ASNS | DNM1 1650/4885SLC22A1 2599/4885ALDH1A1 2331/4885 |
| US-20070135651-A1 | Polymer-stabilised, crystallised, catanionic membranes, preparation method thereof and applications of same | AQP1, AQP3, QARS1 | DNM1 673/4885SLC22A1 323/4885ALDH1A1 4321/4885 |
| US-20080275123-A1 | N-HALOGENATED AMINO ACID FORMULATIONS | BCAT1, BCAT2, SLC7A1 | DNM1 2337/4885SLC22A1 714/4885ALDH1A1 3769/4885 |
“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.