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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28201228 | 0.94 | TSHR (0.37) | TSHR | |
| Water SCHEMBL2779683 | 0.78 | TSHR (0.39) | TSHR | |
| Water SCHEMBL2780526 | 0.78 | TSHR (0.39) | TSHR | |
| Water SCHEMBL319030 | 0.78 | — | — | |
| Water SCHEMBL27607274 | 0.78 | — | — | |
| Water SCHEMBL28075999 | 0.77 | TSHR (0.33) | TSHR | |
| SCHEMBL27929931 | 0.77 | SLC22A1 (0.40) | TSHR | |
| Water SCHEMBL319988 | 0.75 | TSHR (0.37) | TSHR | |
| Hydrochloric Acid SCHEMBL28345550 | 0.75 | TSHR (0.32) | TSHR | |
| Hydrochloric Acid SCHEMBL1914718 | 0.75 | SLC22A1 (0.38) | TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9527030-B2 | Method for preventing fouling of exhaust gas flow path of burning equipment and method for removing ammonium hydrogen sulfate contained in exhaust gas of burning equipment | KURITA WATER INDUSTRIES LTD. (JP) | 2016-12-27 | — | — | US | claimed |
| US-20150224441-A1 | METHOD FOR PREVENTING FOULING OF EXHAUST GAS FLOW PATH OF BURNING EQUIPMENT AND METHOD FOR REMOVING AMMONIUM HYDROGEN SULFATE CONTAINED IN EXHAUST GAS OF BURNING EQUIPMENT | KURITA WATER INDUSTRIES LTD. (JP) | 2015-08-13 | — | — | US | claimed |
| US-9527030-B2 | Method for preventing fouling of exhaust gas flow path of burning equipment and method for removing ammonium hydrogen sulfate contained in exhaust gas of burning equipment | KURITA WATER INDUSTRIES LTD. (JP) | 2016-12-27 | — | — | US | disclosed |
| US-20150224441-A1 | METHOD FOR PREVENTING FOULING OF EXHAUST GAS FLOW PATH OF BURNING EQUIPMENT AND METHOD FOR REMOVING AMMONIUM HYDROGEN SULFATE CONTAINED IN EXHAUST GAS OF BURNING EQUIPMENT | KURITA WATER INDUSTRIES LTD. (JP) | 2015-08-13 | — | — | US | disclosed |