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 | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | APAF1 | O14727 | 2/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | RAD52 | P43351 | 1/20 | 0.67 |
| ▸ | USP2 | O75604 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.67 |
| ▸ | XBP1 | P17861 | 1/20 | 0.67 |
| ▸ | HTT | P42858 | 1/20 | 0.67 |
| ▸ | BLM | P54132 | 1/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL14387168 | 0.98 | HSP90AA1 (0.68) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| SCHEMBL31023557 | 0.98 | HSP90AA1 (0.68) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| Iodide SCHEMBL1788625 | 0.97 | HSP90AA1 (0.67) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| Iodide SCHEMBL1787088 | 0.97 | HSP90AA1 (0.67) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| SCHEMBL10307404 | 0.92 | HSP90AA1 (0.59) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| Iodide SCHEMBL1789963 | 0.91 | HSP90AA1 (0.58) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| Bromide SCHEMBL17906580 | 0.91 | HSP90AA1 (0.62) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| SCHEMBL14075499 | 0.91 | LMNA (0.56) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| SCHEMBL23074606 | 0.89 | HSP90AA1 (0.62) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 | |
| SCHEMBL27450252 | 0.88 | HSP90AA1 (0.60) | HSP90AA1LMNAAPAF1SMN1; SMN2RAD52 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105658322-B | Clay/polymer blends as high pH or ionic liquid barriers | 艾莫考国际公司 | 2021-04-09 | — | — | CN | claimed |
| EP-3019271-A1 | CLAY/POLYMER BLEND AS HIGH PH OR IONIC LIQUID BARRIER | Amcol International Corporation (US) | 2016-05-18 | — | — | EP | claimed |
| WO-2015006746-A1 | CLAY/POLYMER BLEND AS HIGH PH OR IONIC LIQUID BARRIER | AMCOL INTERNATIONAL CORPORATION (US) | 2015-01-15 | — | — | WO | claimed |
| CN-105658322-B | Clay/polymer blends as high pH or ionic liquid barriers | 艾莫考国际公司 | 2021-04-09 | — | — | CN | disclosed |
| EP-3778523-A1 | CLAY/POLYMER BLEND AS HIGH PH OR IONIC LIQUID BARRIER | AMCOL INTERNATIONAL CORPORATION (US) | 2021-02-17 | — | — | EP | disclosed |
| US-9403974-B2 | Clay/polymer blend as high pH or ionic liquid barrier | AMCOL INTERNATIONAL CORPORATION (US) | 2016-08-02 | — | — | US | disclosed |
| EP-3019271-A1 | CLAY/POLYMER BLEND AS HIGH PH OR IONIC LIQUID BARRIER | Amcol International Corporation (US) | 2016-05-18 | — | — | EP | disclosed |
| WO-2015006746-A1 | CLAY/POLYMER BLEND AS HIGH PH OR IONIC LIQUID BARRIER | AMCOL INTERNATIONAL CORPORATION (US) | 2015-01-15 | — | — | WO | disclosed |
| EP-0445627-B1 | Silver halide photographic light-sensitive materials | FUJI PHOTO FILM CO LTD (JP) | 1996-09-11 | — | — | EP | disclosed |
| EP-0445627-A1 | Silver halide photographic light-sensitive materials | FUJI PHOTO FILM CO., LTD. (JP) | 1991-09-11 | — | — | EP | disclosed |