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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 7/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 8/20 | 0.43 |
| ▸ | CA2 | P00918 | 8/20 | 0.43 |
| ▸ | CA9 | Q16790 | 7/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | CA3 | P07451 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
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 SCHEMBL2025641 | 1.00 | DNM1 (0.53) | DNM1HTTKMT2ACA1CA2 | |
| SCHEMBL8885118 | 0.98 | DNM1 (0.55) | DNM1HTTKMT2ACA1CA2 | |
| SCHEMBL1572937 | 0.98 | DNM1 (0.55) | DNM1HTTKMT2ACA1CA2 | |
| SCHEMBL545752 | 0.98 | DNM1 (0.55) | DNM1HTTKMT2ACA1CA2 | |
| SCHEMBL6858953 | 0.98 | DNM1 (0.55) | DNM1HTTKMT2ACA1CA2 | |
| Hydrochloric Acid SCHEMBL8962131 | 0.97 | DNM1 (0.53) | DNM1HTTKMT2ACA1CA2 | |
| Hydrochloric Acid SCHEMBL8961957 | 0.97 | DNM1 (0.53) | DNM1HTTKMT2ACA1CA2 | |
| Bromide SCHEMBL10492709 | 0.97 | DNM1 (0.57) | DNM1HTTKMT2ACA1CA2 | |
| SCHEMBL8436911 | 0.95 | DNM1 (0.55) | DNM1HTTCA1CA2CA9 | |
| SCHEMBL8884394 | 0.95 | DNM1 (0.55) | DNM1HTTCA1CA2CA9 |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120114718-A1 | SOLID-STATE METHOD FOR PRODUCING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID ORGANIC/INORGANIC CHEMICAL SYSTEMS FOR DENTAL REMINERALIZATION APPLICATIONS | KARLINSEY ROBERT L (US) | 2012-05-10 | — | — | US | claimed |
| EP-2120842-A2 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD OF PRODUCING THE SAME | Indiana Nanotech Division of Therametric Technologies, INC. (US) | 2009-11-25 | — | — | EP | claimed |
| WO-2008137190-A2 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD OF PRODUCING THE SAME | INDIANA NANOTECH DIVISION OF THERAMETRIC TECHNOLOGIES, INC. (US) | 2008-11-13 | — | — | WO | claimed |
| US-20080187500-A1 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD FOR PRODUCING THE SAME | INDIANA NANOTECH | 2008-08-07 | — | — | US | claimed |
| EP-2120842-B1 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD OF PRODUCING THE SAME | INDIANA NANOTECH DIVISION OF THERAMETRIC TECH INC (US) | 2019-08-21 | — | — | EP | disclosed |
| US-9023373-B2 | Functionalized calcium phosphate hybrid systems for the remineralization of teeth and a method for producing the same | INDIANA NANOTECH (US) | 2015-05-05 | — | — | US | disclosed |
| US-8587559-B2 | Multipoint nanostructure-film touch screen | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2013-11-19 | — | — | US | disclosed |
| US-8556553-B2 | Hybrid organic/inorganic chemical hybrid systems, including functionalized calcium phosphate hybrid systems, and a solid-state method for producing the same | INDIANA NANOTECH LLC (US) | 2013-10-15 | — | — | US | disclosed |
| US-20120114718-A1 | SOLID-STATE METHOD FOR PRODUCING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID ORGANIC/INORGANIC CHEMICAL SYSTEMS FOR DENTAL REMINERALIZATION APPLICATIONS | KARLINSEY ROBERT L (US) | 2012-05-10 | — | — | US | disclosed |
| US-20100291164-A1 | FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS FOR THE REMINERALIZATION OF TEETH AND A METHOD FOR PRODUCING THE SAME | INDIANA NANOTECH | 2010-11-18 | — | — | US | disclosed |
| EP-2120842-A2 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD OF PRODUCING THE SAME | Indiana Nanotech Division of Therametric Technologies, INC. (US) | 2009-11-25 | — | — | EP | disclosed |
| US-20090085894-A1 | MULTIPOINT NANOSTRUCTURE-FILM TOUCH SCREEN | UNIDYM, INC. (US) | 2009-04-02 | — | — | US | disclosed |
| WO-2008137190-A2 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD OF PRODUCING THE SAME | INDIANA NANOTECH DIVISION OF THERAMETRIC TECHNOLOGIES, INC. (US) | 2008-11-13 | — | — | WO | disclosed |
| US-20080187500-A1 | HYBRID ORGANIC/INORGANIC CHEMICAL HYBRID SYSTEMS, INCLUDING FUNCTIONALIZED CALCIUM PHOSPHATE HYBRID SYSTEMS, AND A SOLID-STATE METHOD FOR PRODUCING THE SAME | INDIANA NANOTECH | 2008-08-07 | — | — | US | disclosed |
| EP-1830809-A2 | INJECTABLE NON-AQUEOUS SUSPENSION | ALZA Corporation (US) | 2007-09-12 | — | — | EP | disclosed |
| US-20070037942-A1 | Preparation of reactive polymeric nanoparticles | BORBELY JANOS | 2007-02-15 | — | — | US | disclosed |
| WO-2006071693-A2 | INJECTABLE NON-AQUEOUS SUSPENSION | ALZA CORPORATION (US) | 2006-07-06 | — | — | WO | disclosed |
| US-20060141040-A1 | Injectable non-aqueous suspension | DURECT CORPORATION | 2006-06-29 | — | — | US | disclosed |
| US-20060142234-A1 | Injectable non-aqueous suspension | DURECT CORPORATION | 2006-06-29 | — | — | US | disclosed |
| US-20060140988-A1 | Visco-supplement composition and methods | DURECT CORPORATION | 2006-06-29 | — | — | US | disclosed |