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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | APEX1 | P27695 | 3/20 | 0.54 |
| ▸ | ACHE | P22303 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL235599 | 0.94 | MEN1 (0.58) | MEN1KMT2AAPEX1ACHELMNA | |
| Fluoride Ion SCHEMBL1444803 | 0.89 | MEN1 (0.54) | MEN1KMT2AAPEX1ACHELMNA | |
| Iodide SCHEMBL1982646 | 0.89 | MEN1 (0.54) | MEN1KMT2AAPEX1ACHELMNA | |
| Bromide SCHEMBL11130043 | 0.89 | MEN1 (0.61) | MEN1KMT2AAPEX1ACHELMNA | |
| Hydrochloric Acid SCHEMBL8339730 | 0.89 | APEX1 (0.61) | MEN1KMT2AAPEX1ACHELMNA | |
| SCHEMBL14754176 | 0.80 | MEN1 (0.47) | MEN1KMT2AAPEX1ACHELMNA | |
| Water SCHEMBL3052288 | 0.80 | MEN1 (0.83) | MEN1KMT2AAPEX1ACHELMNA | |
| Water SCHEMBL813156 | 0.77 | — | — | |
| Hexamethonium SCHEMBL178044 | 0.77 | MEN1 (0.92) | MEN1KMT2AAPEX1ACHELMNA | |
| SCHEMBL10569815 | 0.77 | MEN1 (0.44) | MEN1KMT2AAPEX1ACHELMNA |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260041-A | Novel anti-aging agent and preparation method thereof | 王兴路 | 2022-11-01 | — | — | CN | claimed |
| EP-1468725-B1 | Highly efficient molecular sieve membrane for gases and steams and process for its production | BASF SE (DE) | 2008-11-12 | — | — | EP | claimed |
| EP-1468725-A1 | Highly efficient molecular sieve membrane for gases and steams and process for its production | Institut für Angewandte Chemie Berlin-Adlershof E.V. (DE) | 2004-10-20 | — | — | EP | claimed |
| US-20240117278-A1 | TREATMENT LIQUID, CLEANING METHOD OF SEMICONDUCTOR SUBSTRATE, AND MANUFACTURING METHOD OF SEMICONDUCTOR ELEMENT | FUJIFILM CORPORATION (JP) | 2024-04-11 | — | — | US | disclosed |
| US-7504527-B2 | Low corrosive integrated process for preparing dialkyl carbonates | BADGER LICENSING, LLC (US) | 2009-03-17 | — | — | US | disclosed |
| EP-1468725-B1 | Highly efficient molecular sieve membrane for gases and steams and process for its production | BASF SE (DE) | 2008-11-12 | — | — | EP | disclosed |
| US-7145029-B2 | Low corrosive integrated process for preparing dialkyl carbonates | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-12-05 | — | — | US | disclosed |
| US-20040236136-A1 | Low corrosive integrated process for preparing dialkyl carbonates | BADGER LICENSING, LLC | 2004-11-25 | — | — | US | disclosed |
| EP-1468725-A1 | Highly efficient molecular sieve membrane for gases and steams and process for its production | Institut für Angewandte Chemie Berlin-Adlershof E.V. (DE) | 2004-10-20 | — | — | EP | disclosed |
| US-6774256-B2 | Low corrosive integrated process for preparing dialkyl carbonates | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-08-10 | — | — | US | disclosed |
| US-20040054214-A1 | Low corrosive integrated process for preparing dialkyl carbonates | BADGER LICENSING, LLC | 2004-03-18 | — | — | US | disclosed |
| US-20030023109-A1 | Low corrosive integrated process for preparing dialkyl carbonates | BADGER LICENSING, LLC | 2003-01-30 | — | — | 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 (3 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-20040236136-A1 | Low corrosive integrated process for preparing dialkyl carbonates | DCLK1, DGKI, GALK1 | MEN1 1569/4885KMT2A 2275/4885APEX1 1467/4885 |
| US-20040054214-A1 | Low corrosive integrated process for preparing dialkyl carbonates | DCLK1, DGKI, GALK1 | MEN1 1569/4885KMT2A 2275/4885APEX1 1467/4885 |
| US-20030023109-A1 | Low corrosive integrated process for preparing dialkyl carbonates | DCLK1, DGKI, GALK1 | MEN1 1569/4885KMT2A 2275/4885APEX1 1467/4885 |
“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.